N-butan-2-yl-3-methylpyrrolidine-2-carboxamide

C10H20N2O — CID 102776775

IUPACN-butan-2-yl-3-methylpyrrolidine-2-carboxamide
SMILESCCC(C)NC(=O)C1NCCC1C
InChIInChI=1S/C10H20N2O/c1-4-8(3)12-10(13)9-7(2)5-6-11-9/h7-9,11H,4-6H2,1-3H3,(H,12,13)
InChIKeyLOCUNCDEOFCZNI-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.90
Rot. Bonds3

About N-butan-2-yl-3-methylpyrrolidine-2-carboxamide

N-butan-2-yl-3-methylpyrrolidine-2-carboxamide (PubChem CID 102776775) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-butan-2-yl-3-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-3-methylpyrrolidine-2-carboxamide
PubChem CID102776775
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-butan-2-yl-3-methylpyrrolidine-2-carboxamide
SMILESCCC(C)NC(=O)C1NCCC1C
InChIInChI=1S/C10H20N2O/c1-4-8(3)12-10(13)9-7(2)5-6-11-9/h7-9,11H,4-6H2,1-3H3,(H,12,13)
InChIKeyLOCUNCDEOFCZNI-UHFFFAOYSA-N
XLogP0.90
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-2-carboxamide
CID 102779216
3-methyl-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2-carboxamide
CID 102778392
N-butan-2-yl-2-methylmorpholine-3-carboxamide
CID 130647463
N-(1-cyanobutan-2-yl)-3-methylpyrrolidine-2-carboxamide
CID 102779353
methyl (2S)-2-[(3-methylpyrrolidine-2-carbonyl)amino]propanoate
CID 102778052
2-[(3-methylpyrrolidine-2-carbonyl)amino]butanedioic acid
CID 102779851
3-methyl-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyrrolidine-2-carboxamide
CID 102777521
N-hex-1-yn-3-yl-3-methylpyrrolidine-2-carboxamide
CID 106230636
(2R)-4-hydroxy-2-[(3-methylpyrrolidine-2-carbonyl)amino]butanoic acid
CID 107825151
3-methyl-N-(2-methylbutan-2-yl)pyrrolidine-2-carboxamide
CID 102776765
N-butan-2-ylcyclooctanecarboxamide
CID 65022908
3-methyl-N-(1-phenylbutyl)pyrrolidine-2-carboxamide
CID 102778018

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-3-methylpyrrolidine-2-carboxamide?
The IUPAC name of N-butan-2-yl-3-methylpyrrolidine-2-carboxamide (CID 102776775) is N-butan-2-yl-3-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-butan-2-yl-3-methylpyrrolidine-2-carboxamide?
The canonical SMILES for N-butan-2-yl-3-methylpyrrolidine-2-carboxamide is CCC(C)NC(=O)C1NCCC1C.
What is the InChIKey of N-butan-2-yl-3-methylpyrrolidine-2-carboxamide?
The InChIKey is LOCUNCDEOFCZNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-4-8(3)12-10(13)9-7(2)5-6-11-9/h7-9,11H,4-6H2,1-3H3,(H,12,13).
What are the key properties of N-butan-2-yl-3-methylpyrrolidine-2-carboxamide?
N-butan-2-yl-3-methylpyrrolidine-2-carboxamide has a molecular weight of 184.28 g/mol, XLogP of 0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-3-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 102776775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).