[4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol

C13H20N2O — CID 81237899

IUPAC[4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol
SMILESCN(CC1CCCC1)c1ccncc1CO
InChIInChI=1S/C13H20N2O/c1-15(9-11-4-2-3-5-11)13-6-7-14-8-12(13)10-16/h6-8,11,16H,2-5,9-10H2,1H3
InChIKeyHCWBPXQQLCNVTD-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.20
Rot. Bonds4

About [4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol

[4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol (PubChem CID 81237899) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is [4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol
PubChem CID81237899
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name[4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol
SMILESCN(CC1CCCC1)c1ccncc1CO
InChIInChI=1S/C13H20N2O/c1-15(9-11-4-2-3-5-11)13-6-7-14-8-12(13)10-16/h6-8,11,16H,2-5,9-10H2,1H3
InChIKeyHCWBPXQQLCNVTD-UHFFFAOYSA-N
XLogP2.20
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexylmethyl)-3-(ethylaminomethyl)-N-methylpyridin-4-amine
CID 81248305
[3-[cyclopropylmethyl(methyl)amino]-4-pyridinyl]methanol
CID 105066737
[4-[methyl-(2-methylcyclohexyl)amino]-3-pyridinyl]methanol
CID 81237882
[2-[cyclohexylmethyl(methyl)amino]-5-fluorophenyl]methanol
CID 61446000
[2-[cyclopropylmethyl(methyl)amino]phenyl]methanol
CID 60984636
5-N-(cyclopentylmethyl)-5-N-methylisoquinoline-5,8-diamine
CID 63631040
[4-[2-ethoxyethyl(methyl)amino]-3-pyridinyl]methanol
CID 81237193
[3-(cyclopentylmethoxy)-4-pyridinyl]methanol
CID 105067194
[3-[cyclopropylmethyl(propan-2-yl)amino]-4-pyridinyl]methanol
CID 105066798
[3-[cyclopropyl(methyl)amino]-4-pyridinyl]methanol
CID 105066695
[2-[cyclohexylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol
CID 83184195
[5-chloro-2-[cyclopentylmethyl(methyl)amino]-4-pyridinyl]methanol
CID 114920404

Frequently Asked Questions

What is the IUPAC name of [4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol?
The IUPAC name of [4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol (CID 81237899) is [4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol.
What is the SMILES notation for [4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol?
The canonical SMILES for [4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol is CN(CC1CCCC1)c1ccncc1CO.
What is the InChIKey of [4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol?
The InChIKey is HCWBPXQQLCNVTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-15(9-11-4-2-3-5-11)13-6-7-14-8-12(13)10-16/h6-8,11,16H,2-5,9-10H2,1H3.
What are the key properties of [4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol?
[4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol has a molecular weight of 220.32 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[cyclopentylmethyl(methyl)amino]-3-pyridinyl]methanol is sourced from PubChem (CID 81237899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).