2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide

C19H24N2O2 — CID 112987815

IUPAC2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide
SMILESCC(C)Oc1ccc(Nc2ccc(NC(=O)C(C)C)cc2)cc1
InChIInChI=1S/C19H24N2O2/c1-13(2)19(22)21-17-7-5-15(6-8-17)20-16-9-11-18(12-10-16)23-14(3)4/h5-14,20H,1-4H3,(H,21,22)
InChIKeyQJFZUGODCPNZFF-UHFFFAOYSA-N
MW312.41 g/mol
LogP4.81
Rot. Bonds6

About 2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide

2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide (PubChem CID 112987815) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide
PubChem CID112987815
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide
SMILESCC(C)Oc1ccc(Nc2ccc(NC(=O)C(C)C)cc2)cc1
InChIInChI=1S/C19H24N2O2/c1-13(2)19(22)21-17-7-5-15(6-8-17)20-16-9-11-18(12-10-16)23-14(3)4/h5-14,20H,1-4H3,(H,21,22)
InChIKeyQJFZUGODCPNZFF-UHFFFAOYSA-N
XLogP4.81
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-hydroxy-N-(4-propan-2-yloxyphenyl)propanamide
CID 94684359
2-amino-3,3-dimethyl-N-(4-propan-2-yloxyphenyl)butanamide
CID 76892558
tert-butyl N-[4-(4-propan-2-yloxyanilino)phenyl]carbamate
CID 112987837
2-amino-3-methyl-N-(4-propan-2-yloxyphenyl)butanamide;hydrochloride
CID 119280468
N-[4-[2-(4-chlorophenoxy)propanoylamino]phenyl]-2-methylpropanamide
CID 17187935
2-oxo-2-(4-propan-2-yloxyanilino)acetic acid
CID 28710622
N,N'-bis(4-propan-2-yloxyphenyl)butanediamide
CID 17340345
2-methyl-N-[4-[[(2S)-2-phenoxypropanoyl]amino]phenyl]propanamide
CID 40976571
(2S)-2-amino-4-methyl-N-(4-propan-2-yloxyphenyl)pentanamide
CID 22691065
2-hydroxy-2-phenyl-N-(4-propan-2-yloxyphenyl)acetamide
CID 110896061
N-[4-(4-propan-2-yloxyanilino)phenyl]thiophene-2-carboxamide
CID 112987822
3-amino-3-hydroxyimino-2-methyl-N-(4-propan-2-yloxyphenyl)propanamide
CID 76925190

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide?
The IUPAC name of 2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide (CID 112987815) is 2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide.
What is the SMILES notation for 2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide?
The canonical SMILES for 2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide is CC(C)Oc1ccc(Nc2ccc(NC(=O)C(C)C)cc2)cc1.
What is the InChIKey of 2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide?
The InChIKey is QJFZUGODCPNZFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-13(2)19(22)21-17-7-5-15(6-8-17)20-16-9-11-18(12-10-16)23-14(3)4/h5-14,20H,1-4H3,(H,21,22).
What are the key properties of 2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide?
2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide has a molecular weight of 312.41 g/mol, XLogP of 4.81, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-(4-propan-2-yloxyanilino)phenyl]propanamide is sourced from PubChem (CID 112987815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).