[2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol

C13H21N3O — CID 66278240

IUPAC[2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol
SMILESCc1cnc(NCC2CCCC2CO)c(N)c1
InChIInChI=1S/C13H21N3O/c1-9-5-12(14)13(15-6-9)16-7-10-3-2-4-11(10)8-17/h5-6,10-11,17H,2-4,7-8,14H2,1H3,(H,15,16)
InChIKeyJATPCJRCISFUJQ-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.79
Rot. Bonds4

About [2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol

[2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol (PubChem CID 66278240) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is [2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol
PubChem CID66278240
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name[2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol
SMILESCc1cnc(NCC2CCCC2CO)c(N)c1
InChIInChI=1S/C13H21N3O/c1-9-5-12(14)13(15-6-9)16-7-10-3-2-4-11(10)8-17/h5-6,10-11,17H,2-4,7-8,14H2,1H3,(H,15,16)
InChIKeyJATPCJRCISFUJQ-UHFFFAOYSA-N
XLogP1.79
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(Z)-5-[6-(methylamino)-3-pyridinyl]pent-4-en-1-ol
CID 49792505
[1-(3-Aminopyridin-2-yl)piperidin-4-yl]methanol
CID 43133152
2-[[6-(3-Aminophenyl)pyrazin-2-yl]amino]butan-1-ol
CID 172434790
3-[[6-[3-(Dimethylamino)phenyl]pyrazin-2-yl]amino]propan-1-ol
CID 172435791
3-[[6-(4-Propan-2-ylphenyl)pyrazin-2-yl]amino]propan-1-ol
CID 172438778
(1-(((3-Amino-2-pyridinyl)amino)methyl)cyclopentyl)methanol
CID 385300
4-Phenyl-4-(pyridin-2-ylamino)butan-1-ol
CID 71874383
[1-[3-(Cyclopentylamino)-2-pyridinyl]piperidin-4-yl]methanol
CID 75483325
6-[[(1S,2S)-2-(2-hydroxyethyl)cyclohexyl]amino]pyridine-3-carbonitrile
CID 138014999
(4-Methylcyclohexyl)-[[5-(trifluoromethyl)-2-pyridinyl]amino]methanol
CID 123312856
3-(5-Fluoro-6-piperazin-1-yl-3-pyridinyl)propan-1-ol
CID 123634835
1-(5-Fluoro-6-piperazin-1-yl-3-pyridinyl)propan-2-ol
CID 123788434

Frequently Asked Questions

What is the IUPAC name of [2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
The IUPAC name of [2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol (CID 66278240) is [2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol is Cc1cnc(NCC2CCCC2CO)c(N)c1.
What is the InChIKey of [2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
The InChIKey is JATPCJRCISFUJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-9-5-12(14)13(15-6-9)16-7-10-3-2-4-11(10)8-17/h5-6,10-11,17H,2-4,7-8,14H2,1H3,(H,15,16).
What are the key properties of [2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
[2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol has a molecular weight of 235.33 g/mol, XLogP of 1.79, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 66278240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).