3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide

C19H30N2O — CID 110408201

IUPAC3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide
SMILESCc1ccc(C(CC(=O)NCCCN(C)C)C2CC2)cc1C
InChIInChI=1S/C19H30N2O/c1-14-6-7-17(12-15(14)2)18(16-8-9-16)13-19(22)20-10-5-11-21(3)4/h6-7,12,16,18H,5,8-11,13H2,1-4H3,(H,20,22)
InChIKeyDYCZSYPZJMVUAZ-UHFFFAOYSA-N
MW302.46 g/mol
LogP3.26
Rot. Bonds8

About 3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide

3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide (PubChem CID 110408201) has the molecular formula C19H30N2O and a molecular weight of 302.46 g/mol. Its IUPAC name is 3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide.

Molecular Properties

Compound Name3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide
PubChem CID110408201
Molecular FormulaC19H30N2O
Molecular Weight302.46 g/mol
Exact Mass302.24
IUPAC Name3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide
SMILESCc1ccc(C(CC(=O)NCCCN(C)C)C2CC2)cc1C
InChIInChI=1S/C19H30N2O/c1-14-6-7-17(12-15(14)2)18(16-8-9-16)13-19(22)20-10-5-11-21(3)4/h6-7,12,16,18H,5,8-11,13H2,1-4H3,(H,20,22)
InChIKeyDYCZSYPZJMVUAZ-UHFFFAOYSA-N
XLogP3.26
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.46
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-cyclopropyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(dimethylamino)ethyl]propanamide
CID 110297488
(1R,5R)-1,5-dicyclopropyl-1,5-bis(3,4-dimethylphenyl)pentan-3-one
CID 97304311
N-(4-acetamidophenyl)-3-cyclopropyl-3-(3,4-dimethylphenyl)propanamide
CID 110423890
3-cyclopropyl-3-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)propanamide
CID 110407527
3-cyclopropyl-3-(3,4-dimethylphenyl)propanamide
CID 82079052
3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide
CID 110620228
N-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-3-cyclopropyl-3-(3,4-dimethylphenyl)propanamide
CID 110606301
3-cyclopropyl-N-(2-hydroxy-2-methylpropyl)-3-(4-methoxy-3-methylphenyl)propanamide
CID 110306820
3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide
CID 110301496
1,5-dicyclopentyl-1,5-bis(3,4-dimethylphenyl)pentan-3-one
CID 73011666
3-cyclopropyl-3-(3,4-dimethoxyphenyl)-N-(3-methylbutyl)propanamide
CID 110415573
3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide
CID 110310845

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide?
The IUPAC name of 3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide (CID 110408201) is 3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide.
What is the SMILES notation for 3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide?
The canonical SMILES for 3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide is Cc1ccc(C(CC(=O)NCCCN(C)C)C2CC2)cc1C.
What is the InChIKey of 3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide?
The InChIKey is DYCZSYPZJMVUAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O/c1-14-6-7-17(12-15(14)2)18(16-8-9-16)13-19(22)20-10-5-11-21(3)4/h6-7,12,16,18H,5,8-11,13H2,1-4H3,(H,20,22).
What are the key properties of 3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide?
3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide has a molecular weight of 302.46 g/mol, XLogP of 3.26, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide is sourced from PubChem (CID 110408201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).