(3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol

C105H162F6N14O5 — CID 167601421

IUPAC(3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol
SMILESCC(C)c1ccc(N2C[C@@](C)(O)CC[C@H]2C)cn1.CC(C)c1ccc(N2C[C@](C)(O)CC[C@@H]2C)cn1.CC(C)c1ccc(N2C[C@](C)(O)CC[C@H]2C)cn1.CCC1CCN(c2ccc(C(C)C)nc2)CC1(F)F.CC[C@@H]1CCN(c2ccc(C(C)C)nc2)CC1(F)F.CC[C@H]1CCN(c2ccc(C(C)C)nc2)CC1(F)F.COC1(CO)CCN(c2ccc(C(C)C)nc2)CC1
InChIInChI=1S/3C15H22F2N2.C15H24N2O2.3C15H24N2O/c3*1-4-12-7-8-19(10-15(12,16)17)13-5-6-14(11(2)3)18-9-13;1-12(2)14-5-4-13(10-16-14)17-8-6-15(11-18,19-3)7-9-17;3*1-11(2)14-6-5-13(9-16-14)17-10-15(4,18)8-7-12(17)3/h3*5-6,9,11-12H,4,7-8,10H2,1-3H3;4-5,10,12,18H,6-9,11H2,1-3H3;3*5-6,9,11-12,18H,7-8,10H2,1-4H3/t2*12-;;;2*12-,15+;12-,15-/m10..101/s1
InChIKeyJUCJIERSYGQODP-FSCANEOLSA-N
MW1814.53 g/mol
LogP23.25
Rot. Bonds19

About (3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol

(3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol (PubChem CID 167601421) has the molecular formula C105H162F6N14O5 and a molecular weight of 1814.53 g/mol. Its IUPAC name is (3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name(3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol
PubChem CID167601421
Molecular FormulaC105H162F6N14O5
Molecular Weight1814.53 g/mol
Exact Mass1813.28
IUPAC Name(3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol
SMILESCC(C)c1ccc(N2C[C@@](C)(O)CC[C@H]2C)cn1.CC(C)c1ccc(N2C[C@](C)(O)CC[C@@H]2C)cn1.CC(C)c1ccc(N2C[C@](C)(O)CC[C@H]2C)cn1.CCC1CCN(c2ccc(C(C)C)nc2)CC1(F)F.CC[C@@H]1CCN(c2ccc(C(C)C)nc2)CC1(F)F.CC[C@H]1CCN(c2ccc(C(C)C)nc2)CC1(F)F.COC1(CO)CCN(c2ccc(C(C)C)nc2)CC1
InChIInChI=1S/3C15H22F2N2.C15H24N2O2.3C15H24N2O/c3*1-4-12-7-8-19(10-15(12,16)17)13-5-6-14(11(2)3)18-9-13;1-12(2)14-5-4-13(10-16-14)17-8-6-15(11-18,19-3)7-9-17;3*1-11(2)14-6-5-13(9-16-14)17-10-15(4,18)8-7-12(17)3/h3*5-6,9,11-12H,4,7-8,10H2,1-3H3;4-5,10,12,18H,6-9,11H2,1-3H3;3*5-6,9,11-12,18H,7-8,10H2,1-4H3/t2*12-;;;2*12-,15+;12-,15-/m10..101/s1
InChIKeyJUCJIERSYGQODP-FSCANEOLSA-N
XLogP23.25
TPSA203.06 Ų
H-Bond Donors4
H-Bond Acceptors19
Rotatable Bonds19
Heavy Atoms130
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001814.53
LogP ≤ 523.25
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1019

Analyze (3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol with MolForge

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Frequently Asked Questions

What is the IUPAC name of (3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol?
The IUPAC name of (3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol (CID 167601421) is (3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol.
What is the SMILES notation for (3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol?
The canonical SMILES for (3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol is CC(C)c1ccc(N2C[C@@](C)(O)CC[C@H]2C)cn1.CC(C)c1ccc(N2C[C@](C)(O)CC[C@@H]2C)cn1.CC(C)c1ccc(N2C[C@](C)(O)CC[C@H]2C)cn1.CCC1CCN(c2ccc(C(C)C)nc2)CC1(F)F.CC[C@@H]1CCN(c2ccc(C(C)C)nc2)CC1(F)F.CC[C@H]1CCN(c2ccc(C(C)C)nc2)CC1(F)F.COC1(CO)CCN(c2ccc(C(C)C)nc2)CC1.
What is the InChIKey of (3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol?
The InChIKey is JUCJIERSYGQODP-FSCANEOLSA-N. The full InChI is InChI=1S/3C15H22F2N2.C15H24N2O2.3C15H24N2O/c3*1-4-12-7-8-19(10-15(12,16)17)13-5-6-14(11(2)3)18-9-13;1-12(2)14-5-4-13(10-16-14)17-8-6-15(11-18,19-3)7-9-17;3*1-11(2)14-6-5-13(9-16-14)17-10-15(4,18)8-7-12(17)3/h3*5-6,9,11-12H,4,7-8,10H2,1-3H3;4-5,10,12,18H,6-9,11H2,1-3H3;3*5-6,9,11-12,18H,7-8,10H2,1-4H3/t2*12-;;;2*12-,15+;12-,15-/m10..101/s1.
What are the key properties of (3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol?
(3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol has a molecular weight of 1814.53 g/mol, XLogP of 23.25, 19 rotatable bonds, 4 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6R)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R,6S)-3,6-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;5-(4-ethyl-3,3-difluoropiperidin-1-yl)-2-propan-2-ylpyridine;5-[(4S)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;5-[(4R)-4-ethyl-3,3-difluoropiperidin-1-yl]-2-propan-2-ylpyridine;[4-methoxy-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-yl]methanol is sourced from PubChem (CID 167601421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).