N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide

C15H20N2O2 — CID 95169854

IUPACN-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide
SMILESO=C(NC1CC1)c1ccc(OC[C@@H]2CCCN2)cc1
InChIInChI=1S/C15H20N2O2/c18-15(17-12-5-6-12)11-3-7-14(8-4-11)19-10-13-2-1-9-16-13/h3-4,7-8,12-13,16H,1-2,5-6,9-10H2,(H,17,18)/t13-/m0/s1
InChIKeyOASWAUFWLHENJR-ZDUSSCGKSA-N
MW260.34 g/mol
LogP1.71
Rot. Bonds5

About N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide

N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide (PubChem CID 95169854) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide
PubChem CID95169854
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide
SMILESO=C(NC1CC1)c1ccc(OC[C@@H]2CCCN2)cc1
InChIInChI=1S/C15H20N2O2/c18-15(17-12-5-6-12)11-3-7-14(8-4-11)19-10-13-2-1-9-16-13/h3-4,7-8,12-13,16H,1-2,5-6,9-10H2,(H,17,18)/t13-/m0/s1
InChIKeyOASWAUFWLHENJR-ZDUSSCGKSA-N
XLogP1.71
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4-bromophenyl)-[4-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]methanone
CID 151594530
1-[4-[4-[[(2R)-pyrrolidin-2-yl]methoxy]phenoxy]phenyl]ethanone;hydrochloride
CID 68998757
carbonic acid;N-cyclohexyl-4-(piperidin-4-ylmethoxy)benzamide
CID 67802755
N-cyclopropyl-4-(pyrrolidin-2-ylmethoxy)benzenesulfonamide
CID 62348617
4-[[4-(piperidin-4-ylmethoxy)benzoyl]amino]cyclohexane-1-carboxylic acid
CID 67802753
N-cyclohexyl-4-propoxybenzamide
CID 4938429
4-butoxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 62542341
(2S)-2-[[4-(trifluoromethyl)phenoxy]methyl]pyrrolidine
CID 102820030
4-(cyclopropylmethoxy)-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride
CID 120574690
N-cycloheptyl-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 2125237
4-butoxy-N-cyclobutylbenzamide
CID 71449411
2-[[4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;hydrochloride
CID 129319981

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide?
The IUPAC name of N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide (CID 95169854) is N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide.
What is the SMILES notation for N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide?
The canonical SMILES for N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide is O=C(NC1CC1)c1ccc(OC[C@@H]2CCCN2)cc1.
What is the InChIKey of N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide?
The InChIKey is OASWAUFWLHENJR-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H20N2O2/c18-15(17-12-5-6-12)11-3-7-14(8-4-11)19-10-13-2-1-9-16-13/h3-4,7-8,12-13,16H,1-2,5-6,9-10H2,(H,17,18)/t13-/m0/s1.
What are the key properties of N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide?
N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide has a molecular weight of 260.34 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[[(2S)-pyrrolidin-2-yl]methoxy]benzamide is sourced from PubChem (CID 95169854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).