2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol

C19H30N2O — CID 83993832

IUPAC2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol
SMILESOCCC1CC(NCc2ccccc2)CN(C2CCCC2)C1
InChIInChI=1S/C19H30N2O/c22-11-10-17-12-18(20-13-16-6-2-1-3-7-16)15-21(14-17)19-8-4-5-9-19/h1-3,6-7,17-20,22H,4-5,8-15H2
InChIKeyLGJFMFTYHGVZSN-UHFFFAOYSA-N
MW302.46 g/mol
LogP2.79
Rot. Bonds6

About 2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol

2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol (PubChem CID 83993832) has the molecular formula C19H30N2O and a molecular weight of 302.46 g/mol. Its IUPAC name is 2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol
PubChem CID83993832
Molecular FormulaC19H30N2O
Molecular Weight302.46 g/mol
Exact Mass302.24
IUPAC Name2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol
SMILESOCCC1CC(NCc2ccccc2)CN(C2CCCC2)C1
InChIInChI=1S/C19H30N2O/c22-11-10-17-12-18(20-13-16-6-2-1-3-7-16)15-21(14-17)19-8-4-5-9-19/h1-3,6-7,17-20,22H,4-5,8-15H2
InChIKeyLGJFMFTYHGVZSN-UHFFFAOYSA-N
XLogP2.79
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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

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Related Compounds

3-[5-(benzylamino)-1-cyclobutylpiperidin-3-yl]propan-1-ol
CID 83993883
methyl 5-(benzylamino)-1-cyclobutylpiperidine-3-carboxylate
CID 83993878
2-[3-(benzylamino)-5-(2-hydroxyethyl)piperidin-1-yl]acetic acid
CID 83994006
2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol
CID 83997337
2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol
CID 83989863
N-benzyl-1-cyclopentylpiperidin-3-amine
CID 83993823
methyl 2-[3-(benzylamino)-5-(2-hydroxyethyl)piperidin-1-yl]acetate
CID 83994019
(3S)-N-benzyl-1-cyclopropylpiperidin-3-amine
CID 95912398
3-[1-cyclobutyl-5-(cyclopropylmethylamino)piperidin-3-yl]propan-1-ol
CID 83996650
methyl N-[1-cyclopentyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate
CID 112543328
3-[1-cyclobutyl-5-(cyclopropylamino)piperidin-3-yl]propan-1-ol
CID 83991811
1-[4-(benzylamino)cyclohexyl]pyrrolidin-3-amine
CID 156595341

Frequently Asked Questions

What is the IUPAC name of 2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol?
The IUPAC name of 2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol (CID 83993832) is 2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol.
What is the SMILES notation for 2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol?
The canonical SMILES for 2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol is OCCC1CC(NCc2ccccc2)CN(C2CCCC2)C1.
What is the InChIKey of 2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol?
The InChIKey is LGJFMFTYHGVZSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O/c22-11-10-17-12-18(20-13-16-6-2-1-3-7-16)15-21(14-17)19-8-4-5-9-19/h1-3,6-7,17-20,22H,4-5,8-15H2.
What are the key properties of 2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol?
2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol has a molecular weight of 302.46 g/mol, XLogP of 2.79, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(benzylamino)-1-cyclopentylpiperidin-3-yl]ethanol is sourced from PubChem (CID 83993832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).