[2-(octan-2-ylamino)cyclopentyl]methanol

C14H29NO — CID 115723808

IUPAC[2-(octan-2-ylamino)cyclopentyl]methanol
SMILESCCCCCCC(C)NC1CCCC1CO
InChIInChI=1S/C14H29NO/c1-3-4-5-6-8-12(2)15-14-10-7-9-13(14)11-16/h12-16H,3-11H2,1-2H3
InChIKeyRVZUXHKLAOSGON-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.10
Rot. Bonds8

About [2-(octan-2-ylamino)cyclopentyl]methanol

[2-(octan-2-ylamino)cyclopentyl]methanol (PubChem CID 115723808) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is [2-(octan-2-ylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[2-(octan-2-ylamino)cyclopentyl]methanol
PubChem CID115723808
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name[2-(octan-2-ylamino)cyclopentyl]methanol
SMILESCCCCCCC(C)NC1CCCC1CO
InChIInChI=1S/C14H29NO/c1-3-4-5-6-8-12(2)15-14-10-7-9-13(14)11-16/h12-16H,3-11H2,1-2H3
InChIKeyRVZUXHKLAOSGON-UHFFFAOYSA-N
XLogP3.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

trans-(1R,2R)-2-[[(2S)-heptan-2-yl]amino]cyclohexan-1-ol
CID 124618869
2-(octan-2-ylamino)cyclopentane-1-carbonitrile
CID 62743523
[2-(1-cyclopropylpropan-2-ylamino)cyclopentyl]methanol
CID 115723777
[2-(4-methoxybutan-2-ylamino)cyclohexyl]methanol
CID 115722501
2-[[2-(hydroxymethyl)cyclopentyl]amino]hexanoic acid
CID 106362432
[2-(2-methylpentan-3-ylamino)cyclopentyl]methanol
CID 115723783
2-butyl-N-(4-methoxybutan-2-yl)cyclopentan-1-amine
CID 115716518
N-octan-2-ylcyclohexanamine
CID 13244945
N-nonan-2-ylcyclohexanamine
CID 43129679
[4-(heptan-2-ylamino)cyclohexyl]methanol
CID 103788540
N-[2-(hydroxymethyl)cyclopentyl]nonanamide
CID 103774038
[2-(1-cyclopentylethylamino)cyclopentyl]methanol
CID 115723803

Frequently Asked Questions

What is the IUPAC name of [2-(octan-2-ylamino)cyclopentyl]methanol?
The IUPAC name of [2-(octan-2-ylamino)cyclopentyl]methanol (CID 115723808) is [2-(octan-2-ylamino)cyclopentyl]methanol.
What is the SMILES notation for [2-(octan-2-ylamino)cyclopentyl]methanol?
The canonical SMILES for [2-(octan-2-ylamino)cyclopentyl]methanol is CCCCCCC(C)NC1CCCC1CO.
What is the InChIKey of [2-(octan-2-ylamino)cyclopentyl]methanol?
The InChIKey is RVZUXHKLAOSGON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-3-4-5-6-8-12(2)15-14-10-7-9-13(14)11-16/h12-16H,3-11H2,1-2H3.
What are the key properties of [2-(octan-2-ylamino)cyclopentyl]methanol?
[2-(octan-2-ylamino)cyclopentyl]methanol has a molecular weight of 227.39 g/mol, XLogP of 3.10, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(octan-2-ylamino)cyclopentyl]methanol is sourced from PubChem (CID 115723808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).