3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide

C27H24N2O3 — CID 92674914

IUPAC3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)Nc1ccccc1C(=O)N[C@H](C)c1ccccc1
InChIInChI=1S/C27H24N2O3/c1-18(19-10-4-3-5-11-19)28-26(30)22-14-8-9-15-24(22)29-27(31)23-16-20-12-6-7-13-21(20)17-25(23)32-2/h3-18H,1-2H3,(H,28,30)(H,29,31)/t18-/m1/s1
InChIKeyVSEHGSACHKIXFL-GOSISDBHSA-N
MW424.50 g/mol
LogP5.59
Rot. Bonds6

About 3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide

3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide (PubChem CID 92674914) has the molecular formula C27H24N2O3 and a molecular weight of 424.50 g/mol. Its IUPAC name is 3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide
PubChem CID92674914
Molecular FormulaC27H24N2O3
Molecular Weight424.50 g/mol
Exact Mass424.18
IUPAC Name3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)Nc1ccccc1C(=O)N[C@H](C)c1ccccc1
InChIInChI=1S/C27H24N2O3/c1-18(19-10-4-3-5-11-19)28-26(30)22-14-8-9-15-24(22)29-27(31)23-16-20-12-6-7-13-21(20)17-25(23)32-2/h3-18H,1-2H3,(H,28,30)(H,29,31)/t18-/m1/s1
InChIKeyVSEHGSACHKIXFL-GOSISDBHSA-N
XLogP5.59
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.50
LogP ≤ 55.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide with MolForge

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Related Compounds

3-methoxy-N-[(1R)-1-(4-methylphenyl)ethyl]naphthalene-2-carboxamide
CID 28633409
2-[(2-methoxyphenyl)carbamoylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 100747177
3-methoxy-N-(1-pyridin-3-ylethyl)naphthalene-2-carboxamide
CID 18110339
2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide
CID 4943270
2-N,6-N-bis[2-[[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]carbamoyl]phenyl]pyridine-2,6-dicarboxamide
CID 102216654
2,4-dimethoxy-N-[(1S)-1-phenylethyl]benzamide
CID 814199
2-[(2-bromobenzoyl)amino]-N-(1-phenylethyl)benzamide
CID 4935078
3-methoxy-N-[5-[(3-methoxynaphthalene-2-carbonyl)amino]naphthalen-1-yl]naphthalene-2-carboxamide
CID 5082580
5-bromo-2-ethoxy-N-[2-(1-phenylethylcarbamoyl)phenyl]benzamide
CID 17352958
2,4-dimethyl-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]benzamide
CID 26242918
3-methoxy-N-(3-methylbutan-2-yl)naphthalene-2-carboxamide
CID 133250038
3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide
CID 92675789

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide?
The IUPAC name of 3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide (CID 92674914) is 3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide.
What is the SMILES notation for 3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide?
The canonical SMILES for 3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide is COc1cc2ccccc2cc1C(=O)Nc1ccccc1C(=O)N[C@H](C)c1ccccc1.
What is the InChIKey of 3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide?
The InChIKey is VSEHGSACHKIXFL-GOSISDBHSA-N. The full InChI is InChI=1S/C27H24N2O3/c1-18(19-10-4-3-5-11-19)28-26(30)22-14-8-9-15-24(22)29-27(31)23-16-20-12-6-7-13-21(20)17-25(23)32-2/h3-18H,1-2H3,(H,28,30)(H,29,31)/t18-/m1/s1.
What are the key properties of 3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide?
3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide has a molecular weight of 424.50 g/mol, XLogP of 5.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide is sourced from PubChem (CID 92674914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).