N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide

C18H22N2O2 — CID 120833158

IUPACN-[2-(methylamino)propyl]-3-phenylmethoxybenzamide
SMILESCNC(C)CNC(=O)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C18H22N2O2/c1-14(19-2)12-20-18(21)16-9-6-10-17(11-16)22-13-15-7-4-3-5-8-15/h3-11,14,19H,12-13H2,1-2H3,(H,20,21)
InChIKeyNMQMPPURLCRWJK-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.60
Rot. Bonds7

About N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide

N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide (PubChem CID 120833158) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-[2-(methylamino)propyl]-3-phenylmethoxybenzamide
PubChem CID120833158
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-[2-(methylamino)propyl]-3-phenylmethoxybenzamide
SMILESCNC(C)CNC(=O)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C18H22N2O2/c1-14(19-2)12-20-18(21)16-9-6-10-17(11-16)22-13-15-7-4-3-5-8-15/h3-11,14,19H,12-13H2,1-2H3,(H,20,21)
InChIKeyNMQMPPURLCRWJK-UHFFFAOYSA-N
XLogP2.60
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide
CID 120650597
3-[(3-fluorophenoxy)methyl]-N-[2-(methylamino)propyl]benzamide
CID 120832621
dimethyl-[(1S)-1-phenyl-2-[(3-phenylmethoxybenzoyl)amino]ethyl]azanium
CID 2539131
N-(3-hydroxybutyl)-3-phenylmethoxybenzamide
CID 111433563
N-(3-aminobutyl)-3-phenylmethoxybenzamide;hydrochloride
CID 119497996
3-[(4-chlorophenyl)methoxy]-N-(2-methylpropyl)benzamide
CID 13176390
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120828194
N-pentyl-3-phenylmethoxybenzamide
CID 112759707
N-[(3-methylphenyl)methyl]-3-phenylmethoxybenzamide
CID 50875108
2-methyl-N'-(3-phenylmethoxybenzoyl)benzohydrazide
CID 46520493
N-(4-methyl-2-morpholin-4-ylpentyl)-3-phenylmethoxybenzamide
CID 46540846
N-(2-hydroxypropyl)-3-[(2-methylphenyl)methoxy]benzamide
CID 111432837

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide?
The IUPAC name of N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide (CID 120833158) is N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide.
What is the SMILES notation for N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide?
The canonical SMILES for N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide is CNC(C)CNC(=O)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide?
The InChIKey is NMQMPPURLCRWJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-14(19-2)12-20-18(21)16-9-6-10-17(11-16)22-13-15-7-4-3-5-8-15/h3-11,14,19H,12-13H2,1-2H3,(H,20,21).
What are the key properties of N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide?
N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide has a molecular weight of 298.39 g/mol, XLogP of 2.60, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide is sourced from PubChem (CID 120833158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).