2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide

C13H26N4O — CID 63165424

IUPAC2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide
SMILESCN(C)C1CCN(CC(C)(NC2CC2)C(N)=O)C1
InChIInChI=1S/C13H26N4O/c1-13(12(14)18,15-10-4-5-10)9-17-7-6-11(8-17)16(2)3/h10-11,15H,4-9H2,1-3H3,(H2,14,18)
InChIKeyAAKDEWRYCFZLAN-UHFFFAOYSA-N
MW254.38 g/mol
LogP-0.38
Rot. Bonds6

About 2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide

2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide (PubChem CID 63165424) has the molecular formula C13H26N4O and a molecular weight of 254.38 g/mol. Its IUPAC name is 2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide
PubChem CID63165424
Molecular FormulaC13H26N4O
Molecular Weight254.38 g/mol
Exact Mass254.21
IUPAC Name2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide
SMILESCN(C)C1CCN(CC(C)(NC2CC2)C(N)=O)C1
InChIInChI=1S/C13H26N4O/c1-13(12(14)18,15-10-4-5-10)9-17-7-6-11(8-17)16(2)3/h10-11,15H,4-9H2,1-3H3,(H2,14,18)
InChIKeyAAKDEWRYCFZLAN-UHFFFAOYSA-N
XLogP-0.38
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopropylamino)-5-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpentanamide
CID 63165814
2-amino-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide
CID 63165428
2-(cyclopropylamino)-2-methyl-3-(3,4,5-trimethylpiperazin-1-yl)propanamide
CID 114539436
3-[3-(diethylamino)pyrrolidin-1-yl]-2-methyl-2-(methylamino)propanamide
CID 55158563
2-cyclopropyl-2-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]propanamide
CID 63911504
2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide
CID 62230821
2-(cyclopropylamino)-4-(3,4-dimethylpyrrolidin-1-yl)-2-methylbutanamide
CID 79184111
methyl 2-(cyclopropylamino)-3-(3-methoxypyrrolidin-1-yl)-2-methylpropanoate
CID 103537978
2-(cyclopropylamino)-2-methyl-5-[methyl(2-pyrrolidin-1-ylethyl)amino]pentanamide
CID 63210861
2-methyl-2-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]propanamide
CID 61218639
2-methyl-2-(methylamino)-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propanamide
CID 66371756
2-amino-2-cyclopropyl-3-[3-(dimethylamino)pyrrolidin-1-yl]propan-1-ol
CID 64791303

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide?
The IUPAC name of 2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide (CID 63165424) is 2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide.
What is the SMILES notation for 2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide?
The canonical SMILES for 2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide is CN(C)C1CCN(CC(C)(NC2CC2)C(N)=O)C1.
What is the InChIKey of 2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide?
The InChIKey is AAKDEWRYCFZLAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O/c1-13(12(14)18,15-10-4-5-10)9-17-7-6-11(8-17)16(2)3/h10-11,15H,4-9H2,1-3H3,(H2,14,18).
What are the key properties of 2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide?
2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide has a molecular weight of 254.38 g/mol, XLogP of -0.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide is sourced from PubChem (CID 63165424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).