(2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide

C12H22N2O — CID 174909490

IUPAC(2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide
SMILESCC(C)CN1CCC[C@H]1C(=O)NC1CC1
InChIInChI=1S/C12H22N2O/c1-9(2)8-14-7-3-4-11(14)12(15)13-10-5-6-10/h9-11H,3-8H2,1-2H3,(H,13,15)/t11-/m0/s1
InChIKeyNPFOITCOQVGYOF-NSHDSACASA-N
MW210.32 g/mol
LogP1.39
Rot. Bonds4

About (2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide

(2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide (PubChem CID 174909490) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is (2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide
PubChem CID174909490
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name(2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide
SMILESCC(C)CN1CCC[C@H]1C(=O)NC1CC1
InChIInChI=1S/C12H22N2O/c1-9(2)8-14-7-3-4-11(14)12(15)13-10-5-6-10/h9-11H,3-8H2,1-2H3,(H,13,15)/t11-/m0/s1
InChIKeyNPFOITCOQVGYOF-NSHDSACASA-N
XLogP1.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-cyclopropyl-1-ethylpyrrolidine-2-carboxamide
CID 89087707
(2S)-1-(2-methylpropyl)pyrrolidine-2-carboxylic acid;sulfane
CID 160932725
2-methylpropyl (2S)-2-(cyclopropylcarbamoyl)pyrrolidine-1-carboxylate
CID 6545801
N-cyclopropyl-1-propan-2-ylsulfonylpyrrolidine-2-carboxamide
CID 47372071
N-(4,4-difluorocyclohexyl)-1-propylpyrrolidine-2-carboxamide
CID 11572624
(2R)-N-(2-adamantyl)-1-[(2S)-2-hydroxypropyl]pyrrolidine-2-carboxamide
CID 11645196
1-[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-N-cyclopropylpyrrolidine-2-carboxamide
CID 42884475
N-cyclopropyl-1-[2-(2,4-difluorophenyl)-2-hydroxyethyl]pyrrolidine-2-carboxamide
CID 110903395
(2S)-1-acetyl-N-cyclopropylpyrrolidine-2-carboxamide
CID 143443492
N-cyclopropyl-1-[(2-methylpyrimidin-5-yl)methyl]pyrrolidine-2-carboxamide
CID 146124522
N-cyclopropyl-1-[2-methyl-3-(methylamino)propanoyl]pyrrolidine-2-carboxamide
CID 79202503
1-[(2R)-2-aminopropanoyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride
CID 119291892

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide (CID 174909490) is (2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide is CC(C)CN1CCC[C@H]1C(=O)NC1CC1.
What is the InChIKey of (2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide?
The InChIKey is NPFOITCOQVGYOF-NSHDSACASA-N. The full InChI is InChI=1S/C12H22N2O/c1-9(2)8-14-7-3-4-11(14)12(15)13-10-5-6-10/h9-11H,3-8H2,1-2H3,(H,13,15)/t11-/m0/s1.
What are the key properties of (2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide?
(2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide has a molecular weight of 210.32 g/mol, XLogP of 1.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclopropyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 174909490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).