[6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol

C14H22N2O — CID 80631422

IUPAC[6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol
SMILESCCN(c1ncc(CO)cc1C)C1CCCC1
InChIInChI=1S/C14H22N2O/c1-3-16(13-6-4-5-7-13)14-11(2)8-12(10-17)9-15-14/h8-9,13,17H,3-7,10H2,1-2H3
InChIKeyCULNUHYPTTXEHI-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.65
Rot. Bonds4

About [6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol

[6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol (PubChem CID 80631422) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is [6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol
PubChem CID80631422
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name[6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol
SMILESCCN(c1ncc(CO)cc1C)C1CCCC1
InChIInChI=1S/C14H22N2O/c1-3-16(13-6-4-5-7-13)14-11(2)8-12(10-17)9-15-14/h8-9,13,17H,3-7,10H2,1-2H3
InChIKeyCULNUHYPTTXEHI-UHFFFAOYSA-N
XLogP2.65
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol?
The IUPAC name of [6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol (CID 80631422) is [6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol.
What is the SMILES notation for [6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol?
The canonical SMILES for [6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol is CCN(c1ncc(CO)cc1C)C1CCCC1.
What is the InChIKey of [6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol?
The InChIKey is CULNUHYPTTXEHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-3-16(13-6-4-5-7-13)14-11(2)8-12(10-17)9-15-14/h8-9,13,17H,3-7,10H2,1-2H3.
What are the key properties of [6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol?
[6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol has a molecular weight of 234.34 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol is sourced from PubChem (CID 80631422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).