4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol

C12H19N3O — CID 82286679

IUPAC4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol
SMILESOC1(CNCc2ccccn2)CCNCC1
InChIInChI=1S/C12H19N3O/c16-12(4-7-13-8-5-12)10-14-9-11-3-1-2-6-15-11/h1-3,6,13-14,16H,4-5,7-10H2
InChIKeyBOWSGBLDWGCNKM-UHFFFAOYSA-N
MW221.30 g/mol
LogP0.29
Rot. Bonds4

About 4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol

4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol (PubChem CID 82286679) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol.

Molecular Properties

Compound Name4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol
PubChem CID82286679
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol
SMILESOC1(CNCc2ccccn2)CCNCC1
InChIInChI=1S/C12H19N3O/c16-12(4-7-13-8-5-12)10-14-9-11-3-1-2-6-15-11/h1-3,6,13-14,16H,4-5,7-10H2
InChIKeyBOWSGBLDWGCNKM-UHFFFAOYSA-N
XLogP0.29
TPSA57.18 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 50.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(pyridin-2-ylmethylamino)methyl]thiolan-3-ol
CID 111629685
N-[(1-ethylcyclopropyl)methyl]-1-pyridin-2-ylmethanamine
CID 103735456
4-[[(2-methylphenyl)methylamino]methyl]piperidin-4-ol
CID 126846949
[1-[(pyridin-2-ylmethylamino)methyl]cyclopentyl]methanol
CID 115358745
2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol
CID 115733141
4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]piperidin-4-ol
CID 55048388
zinc;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;dihydrochloride
CID 73345757
1-(pyridin-2-ylmethyl)cyclobutan-1-ol
CID 79081302
4-(anilinomethyl)piperidin-4-ol
CID 56773843
4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride
CID 120615837
N'-(pyridin-2-ylmethyl)-N-[2-(pyridin-2-ylmethylamino)ethyl]ethane-1,2-diamine
CID 12029921
3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
CID 55165709

Frequently Asked Questions

What is the IUPAC name of 4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol?
The IUPAC name of 4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol (CID 82286679) is 4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol.
What is the SMILES notation for 4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol?
The canonical SMILES for 4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol is OC1(CNCc2ccccn2)CCNCC1.
What is the InChIKey of 4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol?
The InChIKey is BOWSGBLDWGCNKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c16-12(4-7-13-8-5-12)10-14-9-11-3-1-2-6-15-11/h1-3,6,13-14,16H,4-5,7-10H2.
What are the key properties of 4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol?
4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol has a molecular weight of 221.30 g/mol, XLogP of 0.29, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol is sourced from PubChem (CID 82286679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).