[2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol

C13H26N2O — CID 106359831

IUPAC[2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol
SMILESNCC1CCCC1NC1CCCCC1CO
InChIInChI=1S/C13H26N2O/c14-8-10-5-3-7-12(10)15-13-6-2-1-4-11(13)9-16/h10-13,15-16H,1-9,14H2
InChIKeyNUKATUFGGVBCAR-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.25
Rot. Bonds4

About [2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol

[2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol (PubChem CID 106359831) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is [2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol
PubChem CID106359831
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name[2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol
SMILESNCC1CCCC1NC1CCCCC1CO
InChIInChI=1S/C13H26N2O/c14-8-10-5-3-7-12(10)15-13-6-2-1-4-11(13)9-16/h10-13,15-16H,1-9,14H2
InChIKeyNUKATUFGGVBCAR-UHFFFAOYSA-N
XLogP1.25
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(hydroxymethyl)cyclohexyl]amino]cyclopentan-1-ol
CID 106361174
[2-(cyclopropylamino)cyclopentyl]methanol
CID 83863384
2-[[2-(hydroxymethyl)cyclohexyl]amino]cycloheptan-1-ol
CID 106361103
4-[[2-(aminomethyl)cyclopentyl]amino]oxolan-3-ol
CID 130679231
[2-[(3-aminocyclobutyl)amino]cyclopentyl]methanol
CID 106359486
[2-[(2-methylthian-3-yl)amino]cyclohexyl]methanol
CID 106359743
[2-[(2,5-dimethylcyclohexyl)amino]cyclopentyl]methanol
CID 106359519
[(1S)-2-(methylamino)cyclopentyl]methanol
CID 123545278
[2-[(2-piperidin-2-ylcyclopentyl)amino]cyclohexyl]methanol
CID 106359616
[(1S,2R)-2-(aminomethyl)cyclopentyl]urea
CID 94903973
[(1R,2S)-2-(hydroxymethyl)cyclopentyl]urea
CID 131092066
[2-[(4-tert-butylcyclohexyl)amino]cyclopentyl]methanol
CID 103700508

Frequently Asked Questions

What is the IUPAC name of [2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol?
The IUPAC name of [2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol (CID 106359831) is [2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol?
The canonical SMILES for [2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol is NCC1CCCC1NC1CCCCC1CO.
What is the InChIKey of [2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol?
The InChIKey is NUKATUFGGVBCAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c14-8-10-5-3-7-12(10)15-13-6-2-1-4-11(13)9-16/h10-13,15-16H,1-9,14H2.
What are the key properties of [2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol?
[2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol has a molecular weight of 226.36 g/mol, XLogP of 1.25, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol is sourced from PubChem (CID 106359831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).