3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol

C13H25NO — CID 115712155

IUPAC3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol
SMILESCC(CC1CCC1)NC1CCCC(O)C1
InChIInChI=1S/C13H25NO/c1-10(8-11-4-2-5-11)14-12-6-3-7-13(15)9-12/h10-15H,2-9H2,1H3
InChIKeyIUPLDZJKHJWMJO-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.46
Rot. Bonds4

About 3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol

3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol (PubChem CID 115712155) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol.

Molecular Properties

Compound Name3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol
PubChem CID115712155
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol
SMILESCC(CC1CCC1)NC1CCCC(O)C1
InChIInChI=1S/C13H25NO/c1-10(8-11-4-2-5-11)14-12-6-3-7-13(15)9-12/h10-15H,2-9H2,1H3
InChIKeyIUPLDZJKHJWMJO-UHFFFAOYSA-N
XLogP2.46
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol
CID 103904559
3-(5-methylhexan-2-ylamino)cyclohexan-1-ol
CID 43751238
N-(1-cyclopropylpropan-2-yl)-3-(2-methylpropyl)cyclohexan-1-amine
CID 107428492
4-(1-cyclopentylpropan-2-ylamino)cyclohexan-1-ol
CID 103904582
3-(propan-2-ylamino)cycloheptan-1-ol
CID 160609920
3-[(1-cyclopropyl-4-methylpentyl)amino]cyclohexan-1-ol
CID 114274449
N-(1-cyclobutylpropan-2-yl)-3-ethylsulfanylcyclopentan-1-amine
CID 115725131
N-butan-2-yl-3-(2-methylpropyl)cyclohexan-1-amine
CID 107427829
3-(1-phenylethylamino)cyclohexan-1-ol
CID 43751335
3-[1-(4-propan-2-ylphenyl)ethylamino]cyclohexan-1-ol
CID 43751281
cis-(1R,3S)-3-(propan-2-ylamino)cyclopentan-1-ol
CID 130990833
N-[1-(oxan-4-yl)propan-2-yl]cyclopentanamine
CID 115704973

Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol?
The IUPAC name of 3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol (CID 115712155) is 3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol.
What is the SMILES notation for 3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol?
The canonical SMILES for 3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol is CC(CC1CCC1)NC1CCCC(O)C1.
What is the InChIKey of 3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol?
The InChIKey is IUPLDZJKHJWMJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-10(8-11-4-2-5-11)14-12-6-3-7-13(15)9-12/h10-15H,2-9H2,1H3.
What are the key properties of 3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol?
3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol has a molecular weight of 211.35 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol is sourced from PubChem (CID 115712155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).