1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol

C19H36N2O — CID 83999419

IUPAC1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol
SMILESCCC(O)CC1CC(NC2CCCCC2)CN(C2CCC2)C1
InChIInChI=1S/C19H36N2O/c1-2-19(22)12-15-11-17(20-16-7-4-3-5-8-16)14-21(13-15)18-9-6-10-18/h15-20,22H,2-14H2,1H3
InChIKeyUXUJKGKZFLUVJW-UHFFFAOYSA-N
MW308.51 g/mol
LogP3.31
Rot. Bonds6

About 1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol

1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol (PubChem CID 83999419) has the molecular formula C19H36N2O and a molecular weight of 308.51 g/mol. Its IUPAC name is 1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol.

Molecular Properties

Compound Name1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol
PubChem CID83999419
Molecular FormulaC19H36N2O
Molecular Weight308.51 g/mol
Exact Mass308.28
IUPAC Name1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol
SMILESCCC(O)CC1CC(NC2CCCCC2)CN(C2CCC2)C1
InChIInChI=1S/C19H36N2O/c1-2-19(22)12-15-11-17(20-16-7-4-3-5-8-16)14-21(13-15)18-9-6-10-18/h15-20,22H,2-14H2,1H3
InChIKeyUXUJKGKZFLUVJW-UHFFFAOYSA-N
XLogP3.31
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.51
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-cyclobutyl-5-(cyclopropylmethylamino)piperidin-3-yl]butan-2-ol
CID 83996653
1-[1-cyclopropyl-5-(methylamino)piperidin-3-yl]butan-2-ol
CID 83989886
N,1-dicyclohexyl-5-ethylpiperidin-3-amine
CID 83999396
1-[5-(cyclohexylamino)-1-propan-2-ylpiperidin-3-yl]butan-2-ol
CID 83999141
1-[1-cyclobutyl-5-(2,2-dimethylpropylamino)piperidin-3-yl]butan-2-ol
CID 83995270
2-[5-(cyclohexylamino)-1-cyclopentylpiperidin-3-yl]acetic acid
CID 83999366
1-[1-cyclohexyl-5-(cyclohexylamino)piperidin-3-yl]ethanol
CID 83999401
5-butyl-1-cyclopentyl-N-cyclopropylpiperidin-3-amine
CID 83991758
1-[3-(cyclopropylamino)-5-(2-hydroxybutyl)piperidin-1-yl]ethanone
CID 83991645
3-[1-cyclobutyl-5-(cyclopropylamino)piperidin-3-yl]propan-1-ol
CID 83991811
2-[1-cyclopentyl-5-(cyclopropylamino)piperidin-3-yl]acetic acid
CID 83991764
3-[5-(cyclohexylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]propan-1-ol
CID 83999427

Frequently Asked Questions

What is the IUPAC name of 1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol?
The IUPAC name of 1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol (CID 83999419) is 1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol.
What is the SMILES notation for 1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol?
The canonical SMILES for 1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol is CCC(O)CC1CC(NC2CCCCC2)CN(C2CCC2)C1.
What is the InChIKey of 1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol?
The InChIKey is UXUJKGKZFLUVJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36N2O/c1-2-19(22)12-15-11-17(20-16-7-4-3-5-8-16)14-21(13-15)18-9-6-10-18/h15-20,22H,2-14H2,1H3.
What are the key properties of 1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol?
1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol has a molecular weight of 308.51 g/mol, XLogP of 3.31, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-cyclobutyl-5-(cyclohexylamino)piperidin-3-yl]butan-2-ol is sourced from PubChem (CID 83999419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).