2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide

C11H21N3O2 — CID 60867427

IUPAC2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide
SMILESCC(NC(=O)CCNC1CC1)C(=O)N(C)C
InChIInChI=1S/C11H21N3O2/c1-8(11(16)14(2)3)13-10(15)6-7-12-9-4-5-9/h8-9,12H,4-7H2,1-3H3,(H,13,15)
InChIKeyJHXRJHARELYICI-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.28
Rot. Bonds6

About 2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide

2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide (PubChem CID 60867427) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide
PubChem CID60867427
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide
SMILESCC(NC(=O)CCNC1CC1)C(=O)N(C)C
InChIInChI=1S/C11H21N3O2/c1-8(11(16)14(2)3)13-10(15)6-7-12-9-4-5-9/h8-9,12H,4-7H2,1-3H3,(H,13,15)
InChIKeyJHXRJHARELYICI-UHFFFAOYSA-N
XLogP-0.28
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclopropylamino)-N-[3-oxo-3-(propan-2-ylamino)propyl]propanamide
CID 113410047
N,N-dimethyl-4-[[3-oxo-3-(propan-2-ylamino)propyl]amino]piperidine-1-carboxamide
CID 115899595
2-(3-aminopropanoylamino)-N,N-dimethylpropanamide
CID 43579388
2-[3-(4-aminocyclohexyl)propanoylamino]-N,N-dimethylpropanamide
CID 55116663
3-[(4-methylcycloheptyl)amino]-N-propan-2-ylpropanamide
CID 113409685
N-propan-2-yl-3-[(4-propan-2-ylcycloheptyl)amino]propanamide
CID 115756514
3-(cyclopropylamino)-N-(1,3-dihydroxypropan-2-yl)propanamide
CID 65314564
N-[3-(butan-2-ylamino)-3-oxopropyl]-3-(cyclopropylamino)propanamide
CID 54901207
N-[2-[[(2S)-1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-oxoethyl]cyclopropanecarboxamide
CID 94191433
(2R)-N,N-dimethyl-2-[3-[(2S)-oxolan-2-yl]propanoylamino]propanamide
CID 94114407
5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide
CID 82012313
N-propan-2-yl-3-(spiro[4.5]decan-8-ylamino)propanamide
CID 114817884

Frequently Asked Questions

What is the IUPAC name of 2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide (CID 60867427) is 2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide is CC(NC(=O)CCNC1CC1)C(=O)N(C)C.
What is the InChIKey of 2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide?
The InChIKey is JHXRJHARELYICI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-8(11(16)14(2)3)13-10(15)6-7-12-9-4-5-9/h8-9,12H,4-7H2,1-3H3,(H,13,15).
What are the key properties of 2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide?
2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide has a molecular weight of 227.31 g/mol, XLogP of -0.28, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide is sourced from PubChem (CID 60867427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).