3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide

C9H19N3O — CID 115690689

IUPAC3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide
SMILESCNC(=O)N1CC(C)C(N(C)C)C1
InChIInChI=1S/C9H19N3O/c1-7-5-12(9(13)10-2)6-8(7)11(3)4/h7-8H,5-6H2,1-4H3,(H,10,13)
InChIKeyJUKYFCNSZALELH-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.21
Rot. Bonds1

About 3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide

3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide (PubChem CID 115690689) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide
PubChem CID115690689
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide
SMILESCNC(=O)N1CC(C)C(N(C)C)C1
InChIInChI=1S/C9H19N3O/c1-7-5-12(9(13)10-2)6-8(7)11(3)4/h7-8H,5-6H2,1-4H3,(H,10,13)
InChIKeyJUKYFCNSZALELH-UHFFFAOYSA-N
XLogP0.21
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-2-oxoacetic acid
CID 81474906
(2R)-2-[[3-(dimethylamino)-4-methylpyrrolidine-1-carbonyl]amino]-3-methylbutanoic acid
CID 81474894
4-[[3-(dimethylamino)-4-methylpyrrolidine-1-carbonyl]amino]butanoic acid
CID 81475356
(2S)-2-[[3-(dimethylamino)-4-methylpyrrolidine-1-carbonyl]amino]pentanoic acid
CID 107567351
(2S)-4-amino-2-[[3-(dimethylamino)-4-methylpyrrolidine-1-carbonyl]amino]-4-oxobutanoic acid
CID 81474444
1-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pentane-1,4-dione
CID 81463828
1-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]prop-2-en-1-one;ethane
CID 172577621
2-bromo-1-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]propan-1-one
CID 107905567
2-[[[3-(dimethylamino)-4-methylpyrrolidine-1-carbonyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 81463935
(2S)-2-[[3-(dimethylamino)-4-methylpyrrolidine-1-carbonyl]amino]hexanoic acid
CID 107146370
2-[1-[[3-(dimethylamino)-4-methylpyrrolidine-1-carbonyl]amino]cyclobutyl]acetic acid
CID 81475038
1-[3-(dimethylamino)-4-methylpyrrolidine-1-carbonyl]cyclopropane-1-carbonitrile
CID 81464602

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide?
The IUPAC name of 3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide (CID 115690689) is 3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide.
What is the SMILES notation for 3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide?
The canonical SMILES for 3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide is CNC(=O)N1CC(C)C(N(C)C)C1.
What is the InChIKey of 3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide?
The InChIKey is JUKYFCNSZALELH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-7-5-12(9(13)10-2)6-8(7)11(3)4/h7-8H,5-6H2,1-4H3,(H,10,13).
What are the key properties of 3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide?
3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide has a molecular weight of 185.27 g/mol, XLogP of 0.21, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N,4-dimethylpyrrolidine-1-carboxamide is sourced from PubChem (CID 115690689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).