2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol

C12H25NO — CID 64757889

IUPAC2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol
SMILESCC(C)CNC(C)(CO)C1CCCC1
InChIInChI=1S/C12H25NO/c1-10(2)8-13-12(3,9-14)11-6-4-5-7-11/h10-11,13-14H,4-9H2,1-3H3
InChIKeyKLRPKWQSHYOFCC-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.17
Rot. Bonds5

About 2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol

2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol (PubChem CID 64757889) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol.

Molecular Properties

Compound Name2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol
PubChem CID64757889
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol
SMILESCC(C)CNC(C)(CO)C1CCCC1
InChIInChI=1S/C12H25NO/c1-10(2)8-13-12(3,9-14)11-6-4-5-7-11/h10-11,13-14H,4-9H2,1-3H3
InChIKeyKLRPKWQSHYOFCC-UHFFFAOYSA-N
XLogP2.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-2-(propylamino)propan-1-ol
CID 64758093
2-cyclopropyl-2-(3-methylbutylamino)propan-1-ol
CID 75453473
(2R)-2-cyclohexyl-2-(2-methoxyethylamino)propan-1-ol
CID 96740613
2-cyclohexyl-2-(cyclopentylamino)propan-1-ol
CID 64758710
(2R)-2-cyclohexyl-2-[(3,5-dimethylphenyl)methylamino]propan-1-ol
CID 99809997
(2S)-2-cyclohexyl-2-[[3-(hydroxymethyl)oxetan-3-yl]methylamino]propan-1-ol
CID 99815019
2-cyclopropyl-2-(2,2,2-trifluoroethylamino)propan-1-ol
CID 61045652
(3R)-N-[(2R)-2-cyclohexyl-1-hydroxypropan-2-yl]-3-hydroxy-4-methylpentanamide
CID 99704485
methanol;N-(2-methylpropyl)cyclopentanamine
CID 166557930
ethane;N-(2-methylpropyl)cyclopentanamine
CID 156893756
2-cycloheptyl-2-methylpropan-1-ol
CID 82936558
N-(2-cyclohexyl-1-hydroxypropan-2-yl)-2-thiomorpholin-4-ylpropanamide
CID 86792246

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol?
The IUPAC name of 2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol (CID 64757889) is 2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol.
What is the SMILES notation for 2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol?
The canonical SMILES for 2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol is CC(C)CNC(C)(CO)C1CCCC1.
What is the InChIKey of 2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol?
The InChIKey is KLRPKWQSHYOFCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-10(2)8-13-12(3,9-14)11-6-4-5-7-11/h10-11,13-14H,4-9H2,1-3H3.
What are the key properties of 2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol?
2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol has a molecular weight of 199.34 g/mol, XLogP of 2.17, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-(2-methylpropylamino)propan-1-ol is sourced from PubChem (CID 64757889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).