2-[4-(methylamino)phenyl]butanamide

C11H16N2O — CID 175192673

IUPAC2-[4-(methylamino)phenyl]butanamide
SMILESCCC(C(N)=O)c1ccc(NC)cc1
InChIInChI=1S/C11H16N2O/c1-3-10(11(12)14)8-4-6-9(13-2)7-5-8/h4-7,10,13H,3H2,1-2H3,(H2,12,14)
InChIKeyBPUJMTIRULMWAT-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.71
Rot. Bonds4

About 2-[4-(methylamino)phenyl]butanamide

2-[4-(methylamino)phenyl]butanamide (PubChem CID 175192673) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-[4-(methylamino)phenyl]butanamide.

Molecular Properties

Compound Name2-[4-(methylamino)phenyl]butanamide
PubChem CID175192673
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-[4-(methylamino)phenyl]butanamide
SMILESCCC(C(N)=O)c1ccc(NC)cc1
InChIInChI=1S/C11H16N2O/c1-3-10(11(12)14)8-4-6-9(13-2)7-5-8/h4-7,10,13H,3H2,1-2H3,(H2,12,14)
InChIKeyBPUJMTIRULMWAT-UHFFFAOYSA-N
XLogP1.71
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(4-chlorophenyl)butanamide
CID 174406593
(2R)-2-phenylbutanamide
CID 139147476
2-pyridin-4-ylbutanamide
CID 67405148
(2S)-2-[4-[(2,3-dichlorophenyl)sulfonylamino]phenyl]butanamide
CID 177299430
N-methyl-2-(4-methylphenyl)butanamide
CID 177273297
(4-butan-2-ylphenyl)-[4-(methylamino)phenyl]methanone
CID 116917421
4-butan-2-yl-N-methylaniline
CID 22675641
ethyl 3-hydroxy-3-[4-(methylamino)phenyl]propanoate
CID 163492180
(3R)-3-amino-3-[4-(methylamino)phenyl]propanoic acid
CID 130649436
[2-acetyloxy-4-(1-amino-1-oxobutan-2-yl)phenyl] acetate
CID 139641545
N,2-bis(4-methylphenyl)butanamide
CID 2750915
2-(4-quinolin-3-ylphenyl)butanamide
CID 66578057

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methylamino)phenyl]butanamide?
The IUPAC name of 2-[4-(methylamino)phenyl]butanamide (CID 175192673) is 2-[4-(methylamino)phenyl]butanamide.
What is the SMILES notation for 2-[4-(methylamino)phenyl]butanamide?
The canonical SMILES for 2-[4-(methylamino)phenyl]butanamide is CCC(C(N)=O)c1ccc(NC)cc1.
What is the InChIKey of 2-[4-(methylamino)phenyl]butanamide?
The InChIKey is BPUJMTIRULMWAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-3-10(11(12)14)8-4-6-9(13-2)7-5-8/h4-7,10,13H,3H2,1-2H3,(H2,12,14).
What are the key properties of 2-[4-(methylamino)phenyl]butanamide?
2-[4-(methylamino)phenyl]butanamide has a molecular weight of 192.26 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methylamino)phenyl]butanamide is sourced from PubChem (CID 175192673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).