4-benzamido-N-(1-methoxypropan-2-yl)benzamide

C18H20N2O3 — CID 17153292

IUPAC4-benzamido-N-(1-methoxypropan-2-yl)benzamide
SMILESCOCC(C)NC(=O)c1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C18H20N2O3/c1-13(12-23-2)19-17(21)15-8-10-16(11-9-15)20-18(22)14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyIWCSQNDAXBPMKC-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.70
Rot. Bonds6

About 4-benzamido-N-(1-methoxypropan-2-yl)benzamide

4-benzamido-N-(1-methoxypropan-2-yl)benzamide (PubChem CID 17153292) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 4-benzamido-N-(1-methoxypropan-2-yl)benzamide.

Molecular Properties

Compound Name4-benzamido-N-(1-methoxypropan-2-yl)benzamide
PubChem CID17153292
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name4-benzamido-N-(1-methoxypropan-2-yl)benzamide
SMILESCOCC(C)NC(=O)c1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C18H20N2O3/c1-13(12-23-2)19-17(21)15-8-10-16(11-9-15)20-18(22)14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyIWCSQNDAXBPMKC-UHFFFAOYSA-N
XLogP2.70
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,4-N-bis[(2R)-1-methoxypropan-2-yl]benzene-1,4-dicarboxamide
CID 25476067
N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide
CID 51219141
4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide
CID 6459980
tert-butyl N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]carbamate
CID 45351440
4-[[(2S)-1-methoxypropan-2-yl]carbamoylamino]-N-methylbenzamide
CID 94811602
N-(1-methoxypropan-2-yl)-3-phenylbenzamide;hydrochloride
CID 172776403
4-benzamido-N-(1-phenylethyl)benzamide
CID 17153199
N-[4-[2-[[(2S)-1-methoxypropan-2-yl]amino]-1,3-thiazol-4-yl]phenyl]benzamide
CID 8750419
4-(2-methoxyethylcarbamoylamino)-N-phenylbenzamide
CID 52793053
methyl 4-[[4-(butan-2-ylcarbamoyl)phenyl]carbamoyl]benzoate
CID 17201378
N-[1-(1-methoxypropan-2-ylamino)-3-methyl-1-oxopentan-2-yl]benzamide
CID 42988908
4-(dimethylamino)-N-(1-methoxypropan-2-yl)benzamide
CID 2904147

Frequently Asked Questions

What is the IUPAC name of 4-benzamido-N-(1-methoxypropan-2-yl)benzamide?
The IUPAC name of 4-benzamido-N-(1-methoxypropan-2-yl)benzamide (CID 17153292) is 4-benzamido-N-(1-methoxypropan-2-yl)benzamide.
What is the SMILES notation for 4-benzamido-N-(1-methoxypropan-2-yl)benzamide?
The canonical SMILES for 4-benzamido-N-(1-methoxypropan-2-yl)benzamide is COCC(C)NC(=O)c1ccc(NC(=O)c2ccccc2)cc1.
What is the InChIKey of 4-benzamido-N-(1-methoxypropan-2-yl)benzamide?
The InChIKey is IWCSQNDAXBPMKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-13(12-23-2)19-17(21)15-8-10-16(11-9-15)20-18(22)14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of 4-benzamido-N-(1-methoxypropan-2-yl)benzamide?
4-benzamido-N-(1-methoxypropan-2-yl)benzamide has a molecular weight of 312.37 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzamido-N-(1-methoxypropan-2-yl)benzamide is sourced from PubChem (CID 17153292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).