2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol

C14H29NO — CID 115895050

IUPAC2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol
SMILESCC(NC(CO)CC(C)(C)C)C1CCCC1
InChIInChI=1S/C14H29NO/c1-11(12-7-5-6-8-12)15-13(10-16)9-14(2,3)4/h11-13,15-16H,5-10H2,1-4H3
InChIKeyWZEDXJCQEZJXOU-UHFFFAOYSA-N
MW227.39 g/mol
LogP2.95
Rot. Bonds5

About 2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol

2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol (PubChem CID 115895050) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol.

Molecular Properties

Compound Name2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol
PubChem CID115895050
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol
SMILESCC(NC(CO)CC(C)(C)C)C1CCCC1
InChIInChI=1S/C14H29NO/c1-11(12-7-5-6-8-12)15-13(10-16)9-14(2,3)4/h11-13,15-16H,5-10H2,1-4H3
InChIKeyWZEDXJCQEZJXOU-UHFFFAOYSA-N
XLogP2.95
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-cyclopropylethylamino)-4,4-dimethylpentan-1-ol
CID 115895052
(2R)-2-(1-cyclopentylethylamino)butan-1-ol
CID 103922643
(2R)-2-(1-cyclopentylethylamino)propan-1-ol
CID 114987079
3-(1-cyclohexylethylamino)-4,4-dimethylpentan-1-ol
CID 113438636
1-cyclohexyl-N-(1-cyclopentylethyl)ethanamine
CID 62633016
N-(1-cyclopentylethyl)propan-2-amine
CID 59833137
N-[(1S)-1-cyclopentylethyl]-2,6-dimethylheptan-4-amine
CID 81386842
3-[[(1R)-1-cycloheptylethyl]amino]-2-methylbutan-2-ol
CID 81389207
3-[[(1R)-1-cyclohexylethyl]amino]-2-methylbutan-2-ol
CID 81384379
N-[(1R)-1-cyclohexylethyl]-5,5-dimethylhexan-2-amine
CID 114279938
N-(1-cyclohexylethyl)-3,3-dimethylbutan-2-amine
CID 104827652
N-[(1S)-1-cyclohexylethyl]-2,6-dimethylheptan-4-amine
CID 81386949

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol?
The IUPAC name of 2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol (CID 115895050) is 2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol.
What is the SMILES notation for 2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol?
The canonical SMILES for 2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol is CC(NC(CO)CC(C)(C)C)C1CCCC1.
What is the InChIKey of 2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol?
The InChIKey is WZEDXJCQEZJXOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-11(12-7-5-6-8-12)15-13(10-16)9-14(2,3)4/h11-13,15-16H,5-10H2,1-4H3.
What are the key properties of 2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol?
2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol has a molecular weight of 227.39 g/mol, XLogP of 2.95, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentylethylamino)-4,4-dimethylpentan-1-ol is sourced from PubChem (CID 115895050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).