N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine

C17H27N3O — CID 95825665

IUPACN-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine
SMILESCN1CCC(c2ccnc(NC[C@@]3(C)CCCO3)c2)CC1
InChIInChI=1S/C17H27N3O/c1-17(7-3-11-21-17)13-19-16-12-15(4-8-18-16)14-5-9-20(2)10-6-14/h4,8,12,14H,3,5-7,9-11,13H2,1-2H3,(H,18,19)/t17-/m1/s1
InChIKeyGXIPZLADIWYBEU-QGZVFWFLSA-N
MW289.42 g/mol
LogP2.87
Rot. Bonds4

About N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine

N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine (PubChem CID 95825665) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine
PubChem CID95825665
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC NameN-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine
SMILESCN1CCC(c2ccnc(NC[C@@]3(C)CCCO3)c2)CC1
InChIInChI=1S/C17H27N3O/c1-17(7-3-11-21-17)13-19-16-12-15(4-8-18-16)14-5-9-20(2)10-6-14/h4,8,12,14H,3,5-7,9-11,13H2,1-2H3,(H,18,19)/t17-/m1/s1
InChIKeyGXIPZLADIWYBEU-QGZVFWFLSA-N
XLogP2.87
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[(2S)-2-methyloxolan-2-yl]methyl]-6-(1-methylpiperidin-4-yl)pyridin-2-amine
CID 95825664
5-tert-butyl-N-[(2-methyloxolan-2-yl)methyl]pyridin-2-amine
CID 114011595
2-methyl-N-[(2-methyloxolan-2-yl)methyl]-6-piperidin-4-ylpyrimidin-4-amine
CID 110090085
6-methyl-N-[(2-methyloxolan-2-yl)methyl]-2-piperidin-4-ylpyrimidin-4-amine
CID 110257564
4-cyclopropyl-N-(2-methylpropyl)pyridin-2-amine
CID 130920688
6-N-[(2-methyloxolan-2-yl)methyl]-2-N-propylpyridine-2,6-diamine
CID 80854388
5-bromo-N-[(2-methyloxolan-2-yl)methyl]isoquinolin-1-amine
CID 103888936
4-N-[(2-methyloxolan-2-yl)methyl]quinoline-4,8-diamine
CID 83061056
N-[(2-methyloxolan-2-yl)methyl]-4-propoxypyrimidin-2-amine
CID 112638214
2-tert-butyl-6-chloro-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine
CID 80951749
2-tert-butyl-N-[(2-methyloxolan-2-yl)methyl]pyrazolo[1,5-a]pyrazin-4-amine
CID 104731862
[4-[4-(1-methylpiperidin-4-yl)-2-pyridinyl]phenyl]methanol
CID 95825449

Frequently Asked Questions

What is the IUPAC name of N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine?
The IUPAC name of N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine (CID 95825665) is N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine.
What is the SMILES notation for N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine?
The canonical SMILES for N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine is CN1CCC(c2ccnc(NC[C@@]3(C)CCCO3)c2)CC1.
What is the InChIKey of N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine?
The InChIKey is GXIPZLADIWYBEU-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H27N3O/c1-17(7-3-11-21-17)13-19-16-12-15(4-8-18-16)14-5-9-20(2)10-6-14/h4,8,12,14H,3,5-7,9-11,13H2,1-2H3,(H,18,19)/t17-/m1/s1.
What are the key properties of N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine?
N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine has a molecular weight of 289.42 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R)-2-methyloxolan-2-yl]methyl]-4-(1-methylpiperidin-4-yl)pyridin-2-amine is sourced from PubChem (CID 95825665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).