N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide

C16H22N2O — CID 97190592

IUPACN-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide
SMILESO=C(NC1CCC1)c1ccc([C@H]2CCCNC2)cc1
InChIInChI=1S/C16H22N2O/c19-16(18-15-4-1-5-15)13-8-6-12(7-9-13)14-3-2-10-17-11-14/h6-9,14-15,17H,1-5,10-11H2,(H,18,19)/t14-/m0/s1
InChIKeyREEJQDZREJFYIW-AWEZNQCLSA-N
MW258.36 g/mol
LogP2.44
Rot. Bonds3

About N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide

N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide (PubChem CID 97190592) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide.

Molecular Properties

Compound NameN-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide
PubChem CID97190592
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC NameN-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide
SMILESO=C(NC1CCC1)c1ccc([C@H]2CCCNC2)cc1
InChIInChI=1S/C16H22N2O/c19-16(18-15-4-1-5-15)13-8-6-12(7-9-13)14-3-2-10-17-11-14/h6-9,14-15,17H,1-5,10-11H2,(H,18,19)/t14-/m0/s1
InChIKeyREEJQDZREJFYIW-AWEZNQCLSA-N
XLogP2.44
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(cyclohexylamino)-3-oxopropyl]-4-[(3R)-piperidin-3-yl]benzamide
CID 97200837
N-cyclohexyl-3-piperidin-3-ylbenzamide;hydrochloride
CID 172654417
N-ethyl-4-piperidin-3-ylbenzamide
CID 172654355
4-amino-N-[(3S)-piperidin-3-yl]benzamide
CID 89225185
N-piperidin-3-ylbenzamide
CID 22017045
4-[(3S)-piperidin-3-yl]benzoic acid;hydrochloride
CID 154574772
1-(4-piperidin-3-ylphenyl)ethanone
CID 83404173
N-(cyclopropylmethyl)-4-piperidin-3-ylbenzamide;hydrochloride
CID 172654364
N-[1-[(3-hydroxyphenyl)methyl]piperidin-4-yl]-4-piperidin-3-ylbenzamide
CID 72845146
4-methyl-N-[4-[(3S)-piperidin-3-yl]phenyl]benzamide
CID 124566433
4-(dimethylamino)-N-piperidin-3-ylbenzamide
CID 43146815
N-[(4S)-azepan-4-yl]benzamide
CID 146196053

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide?
The IUPAC name of N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide (CID 97190592) is N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide.
What is the SMILES notation for N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide?
The canonical SMILES for N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide is O=C(NC1CCC1)c1ccc([C@H]2CCCNC2)cc1.
What is the InChIKey of N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide?
The InChIKey is REEJQDZREJFYIW-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H22N2O/c19-16(18-15-4-1-5-15)13-8-6-12(7-9-13)14-3-2-10-17-11-14/h6-9,14-15,17H,1-5,10-11H2,(H,18,19)/t14-/m0/s1.
What are the key properties of N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide?
N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide has a molecular weight of 258.36 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-4-[(3R)-piperidin-3-yl]benzamide is sourced from PubChem (CID 97190592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).