2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide

C17H29N3O — CID 119849944

IUPAC2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide
SMILESCCN(CC)C(CNC(=O)C(C)(C)N)Cc1ccccc1
InChIInChI=1S/C17H29N3O/c1-5-20(6-2)15(12-14-10-8-7-9-11-14)13-19-16(21)17(3,4)18/h7-11,15H,5-6,12-13,18H2,1-4H3,(H,19,21)
InChIKeyMJAFLBGHCGNZNB-UHFFFAOYSA-N
MW291.44 g/mol
LogP1.79
Rot. Bonds8

About 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide

2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide (PubChem CID 119849944) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide
PubChem CID119849944
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC Name2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide
SMILESCCN(CC)C(CNC(=O)C(C)(C)N)Cc1ccccc1
InChIInChI=1S/C17H29N3O/c1-5-20(6-2)15(12-14-10-8-7-9-11-14)13-19-16(21)17(3,4)18/h7-11,15H,5-6,12-13,18H2,1-4H3,(H,19,21)
InChIKeyMJAFLBGHCGNZNB-UHFFFAOYSA-N
XLogP1.79
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide
CID 119849948
2-amino-N-[2-(diethylamino)-3-phenylpropyl]benzamide
CID 119946555
1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide
CID 119849960
2-amino-N-[2-(diethylamino)-4-methylpentyl]-2-phenylpropanamide;dihydrochloride
CID 120595114
3-amino-N-[2-(diethylamino)-3-phenylpropyl]pyrazine-2-carboxamide
CID 43067611
N-[2-(diethylamino)-3-phenylpropyl]-4-methylsulfonylbenzamide
CID 43067489
N-[2-(diethylamino)-3-phenylpropyl]-1,3-benzodioxole-4-carboxamide
CID 55835831
3-amino-N-[2-(diethylamino)-3-phenylpropyl]bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride
CID 119849953
N-[2-(diethylamino)-3-phenylpropyl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 43067642
N-[2-(diethylamino)-3-phenylpropyl]-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide
CID 87008828
N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide
CID 46447662
N-[(2R)-2-(diethylamino)-3-phenylpropyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 30902992

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide?
The IUPAC name of 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide (CID 119849944) is 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide?
The canonical SMILES for 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide is CCN(CC)C(CNC(=O)C(C)(C)N)Cc1ccccc1.
What is the InChIKey of 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide?
The InChIKey is MJAFLBGHCGNZNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-5-20(6-2)15(12-14-10-8-7-9-11-14)13-19-16(21)17(3,4)18/h7-11,15H,5-6,12-13,18H2,1-4H3,(H,19,21).
What are the key properties of 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide?
2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide has a molecular weight of 291.44 g/mol, XLogP of 1.79, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide is sourced from PubChem (CID 119849944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).