2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol

C12H23NO2 — CID 65108881

IUPAC2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol
SMILESOC1CCCCC1NCC1(O)CCCC1
InChIInChI=1S/C12H23NO2/c14-11-6-2-1-5-10(11)13-9-12(15)7-3-4-8-12/h10-11,13-15H,1-9H2
InChIKeyNJPKBCCKZPBHLI-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.18
Rot. Bonds3

About 2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol

2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol (PubChem CID 65108881) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol
PubChem CID65108881
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol
SMILESOC1CCCCC1NCC1(O)CCCC1
InChIInChI=1S/C12H23NO2/c14-11-6-2-1-5-10(11)13-9-12(15)7-3-4-8-12/h10-11,13-15H,1-9H2
InChIKeyNJPKBCCKZPBHLI-UHFFFAOYSA-N
XLogP1.18
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-hydroxy-4,4-dimethylcyclohexyl)methylamino]cycloheptan-1-ol
CID 65120602
4-ethyl-1-[[(2-hydroxycyclohexyl)amino]methyl]cyclohexan-1-ol
CID 65118682
3-[[[(1R,2R)-2-hydroxycyclohexyl]amino]methyl]oxolan-3-ol
CID 106100705
trans-(1S,2S)-2-[(1-methylcyclopentyl)methylamino]cyclohexan-1-ol
CID 102731253
1-[[(2-propan-2-ylcyclohexyl)amino]methyl]cyclopentan-1-ol
CID 81345241
1-[[[(1S,2S)-2-methylcyclopentyl]amino]methyl]cyclohexan-1-ol
CID 95377558
4-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol
CID 103881245
trans-(1S,2S)-2-[[1-(hydroxymethyl)cyclopentyl]methylamino]cyclopentan-1-ol
CID 102733880
1-[(cycloheptylamino)methyl]cycloheptan-1-ol
CID 60710664
1-[[(4-hydroxycyclohexyl)amino]methyl]cyclohexan-1-ol
CID 103625161
1-[[(2-phenylcyclohexyl)amino]methyl]cyclohexan-1-ol
CID 65107027
trans-(1S,2S)-2-[[1-(hydroxymethyl)cyclohexyl]methylamino]cyclopentan-1-ol
CID 102733972

Frequently Asked Questions

What is the IUPAC name of 2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol?
The IUPAC name of 2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol (CID 65108881) is 2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol.
What is the SMILES notation for 2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol?
The canonical SMILES for 2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol is OC1CCCCC1NCC1(O)CCCC1.
What is the InChIKey of 2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol?
The InChIKey is NJPKBCCKZPBHLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c14-11-6-2-1-5-10(11)13-9-12(15)7-3-4-8-12/h10-11,13-15H,1-9H2.
What are the key properties of 2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol?
2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol has a molecular weight of 213.32 g/mol, XLogP of 1.18, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol is sourced from PubChem (CID 65108881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).