(2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide

C11H20N2O — CID 131000663

IUPAC(2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide
SMILESCCC1(C)CC1NC(=O)[C@@H]1CCCN1
InChIInChI=1S/C11H20N2O/c1-3-11(2)7-9(11)13-10(14)8-5-4-6-12-8/h8-9,12H,3-7H2,1-2H3,(H,13,14)/t8-,9?,11?/m0/s1
InChIKeyUUQNFXNNPUXXEN-SILCLGDVSA-N
MW196.29 g/mol
LogP1.04
Rot. Bonds3

About (2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide

(2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide (PubChem CID 131000663) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is (2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide
PubChem CID131000663
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name(2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide
SMILESCCC1(C)CC1NC(=O)[C@@H]1CCCN1
InChIInChI=1S/C11H20N2O/c1-3-11(2)7-9(11)13-10(14)8-5-4-6-12-8/h8-9,12H,3-7H2,1-2H3,(H,13,14)/t8-,9?,11?/m0/s1
InChIKeyUUQNFXNNPUXXEN-SILCLGDVSA-N
XLogP1.04
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-(2,2-dimethylcyclopropyl)piperidine-2-carboxamide
CID 104913794
(2R)-N-(3-ethoxy-2,2-dimethylcyclobutyl)pyrrolidine-2-carboxamide
CID 113264272
(2S)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119343223
(2S)-N-(3-hydroxy-3-methylcyclohexyl)pyrrolidine-2-carboxamide
CID 90063250
(2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide
CID 104901402
N-(1-ethylazetidin-3-yl)pyrrolidine-2-carboxamide
CID 130638003
(2R)-N-ethylpyrrolidine-2-carboxamide;molecular hydrogen
CID 178045420
(2S)-N-(3,5-dimethylcyclohexyl)pyrrolidine-2-carboxamide
CID 64733303
N-(3-ethoxyspiro[3.5]nonan-1-yl)pyrrolidine-2-carboxamide
CID 119335892
(2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide
CID 103797869
(2S)-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride
CID 66855012
N-propylpyrrolidine-2-carboxamide
CID 4984185

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide (CID 131000663) is (2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide is CCC1(C)CC1NC(=O)[C@@H]1CCCN1.
What is the InChIKey of (2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide?
The InChIKey is UUQNFXNNPUXXEN-SILCLGDVSA-N. The full InChI is InChI=1S/C11H20N2O/c1-3-11(2)7-9(11)13-10(14)8-5-4-6-12-8/h8-9,12H,3-7H2,1-2H3,(H,13,14)/t8-,9?,11?/m0/s1.
What are the key properties of (2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide?
(2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide has a molecular weight of 196.29 g/mol, XLogP of 1.04, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 131000663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).