[2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol

C15H30N2O — CID 114178587

IUPAC[2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol
SMILESCCC1CCCC1(CN)NC1CCCCC1CO
InChIInChI=1S/C15H30N2O/c1-2-13-7-5-9-15(13,11-16)17-14-8-4-3-6-12(14)10-18/h12-14,17-18H,2-11,16H2,1H3
InChIKeyQCSVLZWHEAEFBY-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.03
Rot. Bonds5

About [2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol

[2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol (PubChem CID 114178587) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is [2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol
PubChem CID114178587
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name[2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol
SMILESCCC1CCCC1(CN)NC1CCCCC1CO
InChIInChI=1S/C15H30N2O/c1-2-13-7-5-9-15(13,11-16)17-14-8-4-3-6-12(14)10-18/h12-14,17-18H,2-11,16H2,1H3
InChIKeyQCSVLZWHEAEFBY-UHFFFAOYSA-N
XLogP2.03
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[[3-(aminomethyl)-2-methylthiolan-3-yl]amino]cyclohexyl]methanol
CID 114178599
[2-[[1-(aminomethyl)-2,5-dimethylcyclohexyl]amino]cyclohexyl]methanol
CID 106360359
[2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol
CID 106360313
[2-[[1-(aminomethyl)-3-cyclopropylcyclohexyl]amino]cyclohexyl]methanol
CID 106360376
[2-[[3-(aminomethyl)oxolan-3-yl]amino]cyclohexyl]methanol
CID 106360446
[2-[[1-(aminomethyl)-3,5-dimethylcyclohexyl]amino]cyclopentyl]methanol
CID 106359954
[2-[[4-(aminomethyl)-1-(2-methylpropyl)piperidin-4-yl]amino]cyclohexyl]methanol
CID 106360413
[2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol
CID 106359944
[(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol
CID 169429799
N-[1-(aminomethyl)-2-ethylcyclopentyl]-4-bromo-3,5-dimethylaniline
CID 107573260
[2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol
CID 106359831
N-[1-(aminomethyl)-2-ethylcyclohexyl]-4-bromo-3,5-dimethylaniline
CID 107573250

Frequently Asked Questions

What is the IUPAC name of [2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol?
The IUPAC name of [2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol (CID 114178587) is [2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol?
The canonical SMILES for [2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol is CCC1CCCC1(CN)NC1CCCCC1CO.
What is the InChIKey of [2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol?
The InChIKey is QCSVLZWHEAEFBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-2-13-7-5-9-15(13,11-16)17-14-8-4-3-6-12(14)10-18/h12-14,17-18H,2-11,16H2,1H3.
What are the key properties of [2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol?
[2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol has a molecular weight of 254.42 g/mol, XLogP of 2.03, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol is sourced from PubChem (CID 114178587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).