(2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide

C23H26N2O — CID 2438566

IUPAC(2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide
SMILESCC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)Nc1ccc2ccccc2c1
InChIInChI=1S/C23H26N2O/c1-4-16(2)21-11-7-8-12-22(21)25-23(26)17(3)24-20-14-13-18-9-5-6-10-19(18)15-20/h5-17,24H,4H2,1-3H3,(H,25,26)/t16-,17-/m1/s1
InChIKeyFOKIXITXZIJWJY-IAGOWNOFSA-N
MW346.47 g/mol
LogP5.79
Rot. Bonds6

About (2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide

(2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide (PubChem CID 2438566) has the molecular formula C23H26N2O and a molecular weight of 346.47 g/mol. Its IUPAC name is (2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide.

Molecular Properties

Compound Name(2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide
PubChem CID2438566
Molecular FormulaC23H26N2O
Molecular Weight346.47 g/mol
Exact Mass346.20
IUPAC Name(2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide
SMILESCC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)Nc1ccc2ccccc2c1
InChIInChI=1S/C23H26N2O/c1-4-16(2)21-11-7-8-12-22(21)25-23(26)17(3)24-20-14-13-18-9-5-6-10-19(18)15-20/h5-17,24H,4H2,1-3H3,(H,25,26)/t16-,17-/m1/s1
InChIKeyFOKIXITXZIJWJY-IAGOWNOFSA-N
XLogP5.79
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.47
LogP ≤ 55.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-[3-(methanesulfonamido)anilino]propanamide
CID 37329690
N-[2-[(2S)-butan-2-yl]phenyl]-2-methylpropanamide
CID 959786
(2R)-2-acetamido-N-[2-[(2S)-butan-2-yl]phenyl]propanamide
CID 8894212
2-(naphthalen-2-ylamino)-N-propylpropanamide
CID 43401181
(2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide
CID 39415589
2-(3,4-dimethylanilino)-N-naphthalen-2-ylpropanamide
CID 78666889
N-[2-[(2R)-butan-2-yl]phenyl]acetamide
CID 959734
2-(naphthalen-2-ylamino)-N-pentylpropanamide
CID 43420250
2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide
CID 26506452
N-(2-butan-2-ylphenyl)-3-chloro-2-methylpropanamide
CID 55110758
N-(3-methylbutyl)-2-(naphthalen-2-ylamino)propanamide
CID 43420253
1-[2-[(2R)-butan-2-yl]phenyl]-3-(4-ethoxyphenyl)urea
CID 970476

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide?
The IUPAC name of (2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide (CID 2438566) is (2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide.
What is the SMILES notation for (2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide?
The canonical SMILES for (2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide is CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)Nc1ccc2ccccc2c1.
What is the InChIKey of (2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide?
The InChIKey is FOKIXITXZIJWJY-IAGOWNOFSA-N. The full InChI is InChI=1S/C23H26N2O/c1-4-16(2)21-11-7-8-12-22(21)25-23(26)17(3)24-20-14-13-18-9-5-6-10-19(18)15-20/h5-17,24H,4H2,1-3H3,(H,25,26)/t16-,17-/m1/s1.
What are the key properties of (2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide?
(2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide has a molecular weight of 346.47 g/mol, XLogP of 5.79, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(naphthalen-2-ylamino)propanamide is sourced from PubChem (CID 2438566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).