(2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide

C22H34N4O2 — CID 126423361

IUPAC(2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide
SMILESO=C(NCC1(N2CCOCC2)CCCCC1)N1CCCC[C@@H]1c1cccnc1
InChIInChI=1S/C22H34N4O2/c27-21(26-12-5-2-8-20(26)19-7-6-11-23-17-19)24-18-22(9-3-1-4-10-22)25-13-15-28-16-14-25/h6-7,11,17,20H,1-5,8-10,12-16,18H2,(H,24,27)/t20-/m1/s1
InChIKeyLAKAMMJECCEMBV-HXUWFJFHSA-N
MW386.54 g/mol
LogP3.35
Rot. Bonds4

About (2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide

(2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide (PubChem CID 126423361) has the molecular formula C22H34N4O2 and a molecular weight of 386.54 g/mol. Its IUPAC name is (2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide
PubChem CID126423361
Molecular FormulaC22H34N4O2
Molecular Weight386.54 g/mol
Exact Mass386.27
IUPAC Name(2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide
SMILESO=C(NCC1(N2CCOCC2)CCCCC1)N1CCCC[C@@H]1c1cccnc1
InChIInChI=1S/C22H34N4O2/c27-21(26-12-5-2-8-20(26)19-7-6-11-23-17-19)24-18-22(9-3-1-4-10-22)25-13-15-28-16-14-25/h6-7,11,17,20H,1-5,8-10,12-16,18H2,(H,24,27)/t20-/m1/s1
InChIKeyLAKAMMJECCEMBV-HXUWFJFHSA-N
XLogP3.35
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.54
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide?
The IUPAC name of (2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide (CID 126423361) is (2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide.
What is the SMILES notation for (2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide?
The canonical SMILES for (2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide is O=C(NCC1(N2CCOCC2)CCCCC1)N1CCCC[C@@H]1c1cccnc1.
What is the InChIKey of (2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide?
The InChIKey is LAKAMMJECCEMBV-HXUWFJFHSA-N. The full InChI is InChI=1S/C22H34N4O2/c27-21(26-12-5-2-8-20(26)19-7-6-11-23-17-19)24-18-22(9-3-1-4-10-22)25-13-15-28-16-14-25/h6-7,11,17,20H,1-5,8-10,12-16,18H2,(H,24,27)/t20-/m1/s1.
What are the key properties of (2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide?
(2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide has a molecular weight of 386.54 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-3-ylpiperidine-1-carboxamide is sourced from PubChem (CID 126423361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).