1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol

C12H23NO — CID 64593899

IUPAC1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol
SMILESCC(O)CNC1CCCC(C2CC2)C1
InChIInChI=1S/C12H23NO/c1-9(14)8-13-12-4-2-3-11(7-12)10-5-6-10/h9-14H,2-8H2,1H3
InChIKeyHBAOTPABGLOWTA-UHFFFAOYSA-N
MW197.32 g/mol
LogP1.93
Rot. Bonds4

About 1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol

1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol (PubChem CID 64593899) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol
PubChem CID64593899
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol
SMILESCC(O)CNC1CCCC(C2CC2)C1
InChIInChI=1S/C12H23NO/c1-9(14)8-13-12-4-2-3-11(7-12)10-5-6-10/h9-14H,2-8H2,1H3
InChIKeyHBAOTPABGLOWTA-UHFFFAOYSA-N
XLogP1.93
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-3-methylbutan-2-ol
CID 115720450
(2S)-5-[[(1R,3R)-3-cyclopropylcyclohexyl]amino]-4,4-dimethylpentan-2-ol
CID 124864824
1-(cyclooctylamino)propan-2-ol
CID 20539535
1-(cycloheptylamino)propan-2-ol
CID 43392225
(2S)-1-(cyclopropylamino)propan-2-ol
CID 39234971
N-(2-cyclopropylpropyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 115592687
3-cyclopropyl-N-(2,2,3-trimethylbutyl)cyclohexan-1-amine
CID 114099437
5-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)pentan-2-ol
CID 107270410
2-[(3-cyclopropylcyclohexyl)amino]propan-1-ol
CID 64593901
(2R)-1-[[(1S,3S,4R)-3,4-dimethylcyclohexyl]amino]propan-2-ol
CID 96732492
3-cyclopropyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine
CID 64624615
(2R)-1-[(1,2-dimethylpiperidin-4-yl)amino]propan-2-ol
CID 103906841

Frequently Asked Questions

What is the IUPAC name of 1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol?
The IUPAC name of 1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol (CID 64593899) is 1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol.
What is the SMILES notation for 1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol?
The canonical SMILES for 1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol is CC(O)CNC1CCCC(C2CC2)C1.
What is the InChIKey of 1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol?
The InChIKey is HBAOTPABGLOWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-9(14)8-13-12-4-2-3-11(7-12)10-5-6-10/h9-14H,2-8H2,1H3.
What are the key properties of 1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol?
1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol has a molecular weight of 197.32 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol is sourced from PubChem (CID 64593899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).