3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol

C19H30N2O — CID 83993883

IUPAC3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol
SMILESOCCCC1CC(NCc2ccccc2)CN(C2CCC2)C1
InChIInChI=1S/C19H30N2O/c22-11-5-8-17-12-18(15-21(14-17)19-9-4-10-19)20-13-16-6-2-1-3-7-16/h1-3,6-7,17-20,22H,4-5,8-15H2
InChIKeyJOFYZZWBKCKIBP-UHFFFAOYSA-N
MW302.46 g/mol
LogP2.79
Rot. Bonds7

About 3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol

3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol (PubChem CID 83993883) has the molecular formula C19H30N2O and a molecular weight of 302.46 g/mol. Its IUPAC name is 3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol.

Molecular Properties

Compound Name3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol
PubChem CID83993883
Molecular FormulaC19H30N2O
Molecular Weight302.46 g/mol
Exact Mass302.24
IUPAC Name3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol
SMILESOCCCC1CC(NCc2ccccc2)CN(C2CCC2)C1
InChIInChI=1S/C19H30N2O/c22-11-5-8-17-12-18(15-21(14-17)19-9-4-10-19)20-13-16-6-2-1-3-7-16/h1-3,6-7,17-20,22H,4-5,8-15H2
InChIKeyJOFYZZWBKCKIBP-UHFFFAOYSA-N
XLogP2.79
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.46
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol
CID 83993832
3-[1-cyclobutyl-5-(cyclopropylmethylamino)piperidin-3-yl]propan-1-ol
CID 83996650
3-[1-cyclobutyl-5-(cyclopropylamino)piperidin-3-yl]propan-1-ol
CID 83991811
methyl 5-(benzylamino)-1-cyclobutylpiperidine-3-carboxylate
CID 83993878
1-[3-(benzylamino)-5-(3-hydroxypropyl)piperidin-1-yl]butan-1-one
CID 83993717
2-[3-(benzylamino)-5-(2-hydroxyethyl)piperidin-1-yl]acetic acid
CID 83994006
2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol
CID 83997337
N-benzyl-1-cyclopentylpiperidin-3-amine
CID 83993823
N-benzyl-5-butyl-1-methylpiperidin-3-amine
CID 83993440
N-benzyl-5-butyl-1-(cyclopropylmethyl)piperidin-3-amine
CID 83993911
(3S)-N-benzyl-1-cyclopropylpiperidin-3-amine
CID 95912398
methyl 2-[3-(benzylamino)-5-(2-hydroxyethyl)piperidin-1-yl]acetate
CID 83994019

Frequently Asked Questions

What is the IUPAC name of 3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol?
The IUPAC name of 3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol (CID 83993883) is 3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol.
What is the SMILES notation for 3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol?
The canonical SMILES for 3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol is OCCCC1CC(NCc2ccccc2)CN(C2CCC2)C1.
What is the InChIKey of 3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol?
The InChIKey is JOFYZZWBKCKIBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O/c22-11-5-8-17-12-18(15-21(14-17)19-9-4-10-19)20-13-16-6-2-1-3-7-16/h1-3,6-7,17-20,22H,4-5,8-15H2.
What are the key properties of 3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol?
3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol has a molecular weight of 302.46 g/mol, XLogP of 2.79, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol is sourced from PubChem (CID 83993883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).