N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide

C11H22N2O — CID 64597278

IUPACN-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide
SMILESCC(C)C(C)CNC(=O)C1CCCN1
InChIInChI=1S/C11H22N2O/c1-8(2)9(3)7-13-11(14)10-5-4-6-12-10/h8-10,12H,4-7H2,1-3H3,(H,13,14)
InChIKeyNOJWKDYFTUOIAI-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.15
Rot. Bonds4

About N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide

N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide (PubChem CID 64597278) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide
PubChem CID64597278
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide
SMILESCC(C)C(C)CNC(=O)C1CCCN1
InChIInChI=1S/C11H22N2O/c1-8(2)9(3)7-13-11(14)10-5-4-6-12-10/h8-10,12H,4-7H2,1-3H3,(H,13,14)
InChIKeyNOJWKDYFTUOIAI-UHFFFAOYSA-N
XLogP1.15
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyclopropylpropyl)pyrrolidine-2-carboxamide
CID 115591240
N-(2-methylsulfanylpropyl)pyrrolidine-2-carboxamide
CID 115976802
(2S)-N-[(2R)-2-(1-hydroxyethylamino)propyl]pyrrolidine-2-carboxamide
CID 148575646
N-(2,3-dimethylbutyl)-3-methylpiperidine-2-carboxamide
CID 64599745
(2S)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)pyrrolidine-2-carboxamide
CID 61273549
N-(2,2-dimethoxyethyl)pyrrolidine-2-carboxamide
CID 61275078
(2S)-N-(2-methoxypropyl)piperidine-2-carboxamide
CID 102695060
N-(2-aminopropyl)piperidine-2-carboxamide;hydrochloride
CID 130685962
4-methyl-5-[[(2R)-pyrrolidine-2-carbonyl]amino]pentanoic acid
CID 104901378
(2S)-N-(2-piperidin-1-ylpropyl)pyrrolidine-2-carboxamide
CID 61165549
N-(2-cyclopropyl-2-hydroxyethyl)pyrrolidine-2-carboxamide
CID 63297013
(2S)-N-[2-(2-methylpropanoylamino)ethyl]pyrrolidine-2-carboxamide
CID 61249248

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide (CID 64597278) is N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide is CC(C)C(C)CNC(=O)C1CCCN1.
What is the InChIKey of N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide?
The InChIKey is NOJWKDYFTUOIAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-8(2)9(3)7-13-11(14)10-5-4-6-12-10/h8-10,12H,4-7H2,1-3H3,(H,13,14).
What are the key properties of N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide?
N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide has a molecular weight of 198.31 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylbutyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 64597278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).