N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide

C13H24N2O — CID 106981268

IUPACN-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide
SMILESCC(C)C1(C(=O)NC2(C)CCC2)CCNC1
InChIInChI=1S/C13H24N2O/c1-10(2)13(7-8-14-9-13)11(16)15-12(3)5-4-6-12/h10,14H,4-9H2,1-3H3,(H,15,16)
InChIKeyJZGNKSZDMWNART-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.68
Rot. Bonds3

About N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide

N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide (PubChem CID 106981268) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide
PubChem CID106981268
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide
SMILESCC(C)C1(C(=O)NC2(C)CCC2)CCNC1
InChIInChI=1S/C13H24N2O/c1-10(2)13(7-8-14-9-13)11(16)15-12(3)5-4-6-12/h10,14H,4-9H2,1-3H3,(H,15,16)
InChIKeyJZGNKSZDMWNART-UHFFFAOYSA-N
XLogP1.68
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(hydroxymethyl)cyclobutyl]-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106981299
3-propan-2-ylpyrrolidine-3-carbohydrazide
CID 106980734
4-[(3-propan-2-ylpyrrolidine-3-carbonyl)amino]oxane-4-carboxylic acid
CID 106981085
N-(3,3-dimethylbutan-2-yl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106981240
N-ethylsulfonyl-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106981399
N-[(2R)-1-hydroxypropan-2-yl]-3-propan-2-ylpyrrolidine-3-carboxamide
CID 107218541
N-(2,2-dimethylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106980333
N-(4-hydroxy-3-methylbutan-2-yl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106981266
N-[1-(dimethylamino)-1-oxopropan-2-yl]-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106979756
N-(4-acetamidophenyl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106979608
N-(4-fluorophenyl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106979554
N-(2-methylbut-3-yn-2-yl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106980737

Frequently Asked Questions

What is the IUPAC name of N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide?
The IUPAC name of N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide (CID 106981268) is N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide is CC(C)C1(C(=O)NC2(C)CCC2)CCNC1.
What is the InChIKey of N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide?
The InChIKey is JZGNKSZDMWNART-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-10(2)13(7-8-14-9-13)11(16)15-12(3)5-4-6-12/h10,14H,4-9H2,1-3H3,(H,15,16).
What are the key properties of N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide?
N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide has a molecular weight of 224.35 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylcyclobutyl)-3-propan-2-ylpyrrolidine-3-carboxamide is sourced from PubChem (CID 106981268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).