2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide

C14H23N3O — CID 90816184

IUPAC2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide
SMILESCNc1ccc(CC(C(=O)N(C)C)N(C)C)cc1
InChIInChI=1S/C14H23N3O/c1-15-12-8-6-11(7-9-12)10-13(16(2)3)14(18)17(4)5/h6-9,13,15H,10H2,1-5H3
InChIKeyFNCBCYLKECNUHA-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.29
Rot. Bonds5

About 2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide

2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide (PubChem CID 90816184) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide.

Molecular Properties

Compound Name2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide
PubChem CID90816184
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide
SMILESCNc1ccc(CC(C(=O)N(C)C)N(C)C)cc1
InChIInChI=1S/C14H23N3O/c1-15-12-8-6-11(7-9-12)10-13(16(2)3)14(18)17(4)5/h6-9,13,15H,10H2,1-5H3
InChIKeyFNCBCYLKECNUHA-UHFFFAOYSA-N
XLogP1.29
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(methylamino)phenyl]propan-2-ol
CID 142796723
(2S)-2-(dimethylamino)-3-(4-hydroxyphenyl)propanamide
CID 70366423
N-[4-[2-(dimethylamino)-3-phenylpropanoyl]phenyl]acetamide
CID 4534125
N-methyl-4-[[4-(methylamino)phenyl]methyl]aniline
CID 15735
4-[(dimethylamino)methyl]-N-methylaniline
CID 59619039
1,5-bis[4-(methylamino)phenyl]pentan-3-one
CID 175944254
N-methyl-4-[4-(2-methylpropyl)phenyl]aniline
CID 116962445
2-(dimethylamino)-3-(3-methylphenyl)propanoic acid
CID 59981449
[4-(methylamino)phenyl]methyl N-[2-[ethoxycarbonyl(methyl)amino]ethyl]-N-methylcarbamate
CID 171843698
tert-butyl-[(2S)-1-(dimethylamino)-1-oxo-3-phenylpropan-2-yl]carbamic acid
CID 67430309
N-methyl-4-[2-(methylamino)penta-3,4-dienyl]aniline
CID 144820001
2-(dimethylamino)-1,3-diphenylpropan-1-one;hydrochloride
CID 15945335

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide?
The IUPAC name of 2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide (CID 90816184) is 2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide.
What is the SMILES notation for 2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide?
The canonical SMILES for 2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide is CNc1ccc(CC(C(=O)N(C)C)N(C)C)cc1.
What is the InChIKey of 2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide?
The InChIKey is FNCBCYLKECNUHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-15-12-8-6-11(7-9-12)10-13(16(2)3)14(18)17(4)5/h6-9,13,15H,10H2,1-5H3.
What are the key properties of 2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide?
2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide has a molecular weight of 249.36 g/mol, XLogP of 1.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N,N-dimethyl-3-[4-(methylamino)phenyl]propanamide is sourced from PubChem (CID 90816184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).