N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide

C10H18N2O3S — CID 47158071

IUPACN-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide
SMILESCS(=O)(=O)N1CCCC1C(=O)NCC1CC1
InChIInChI=1S/C10H18N2O3S/c1-16(14,15)12-6-2-3-9(12)10(13)11-7-8-4-5-8/h8-9H,2-7H2,1H3,(H,11,13)
InChIKeyWWNXHADSVOJNHT-UHFFFAOYSA-N
MW246.33 g/mol
LogP-0.06
Rot. Bonds4

About N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide

N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide (PubChem CID 47158071) has the molecular formula C10H18N2O3S and a molecular weight of 246.33 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide
PubChem CID47158071
Molecular FormulaC10H18N2O3S
Molecular Weight246.33 g/mol
Exact Mass246.10
IUPAC NameN-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide
SMILESCS(=O)(=O)N1CCCC1C(=O)NCC1CC1
InChIInChI=1S/C10H18N2O3S/c1-16(14,15)12-6-2-3-9(12)10(13)11-7-8-4-5-8/h8-9H,2-7H2,1H3,(H,11,13)
InChIKeyWWNXHADSVOJNHT-UHFFFAOYSA-N
XLogP-0.06
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.33
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(3-hydroxycyclopentyl)methyl]-1-methylsulfonylpiperidine-2-carboxamide
CID 103280167
(2R)-1-methylsulfonyl-N-[[(2R)-oxolan-2-yl]methyl]pyrrolidine-2-carboxamide
CID 124748947
(2S)-1-methylsulfonyl-N-[[(1S,3R)-3-[[(2R)-oxolane-2-carbonyl]amino]cyclopentyl]methyl]pyrrolidine-2-carboxamide
CID 166378342
(2R)-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-1-methylsulfonylpiperidine-2-carboxamide
CID 124831536
N-(3-methyl-2-propan-2-ylbutyl)-1-methylsulfonylpyrrolidine-2-carboxamide
CID 102915113
1-methylsulfonyl-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]pyrrolidine-2-carboxamide
CID 49056443
2,2-dimethyl-3-[[(2S)-1-methylsulfonylpyrrolidine-2-carbonyl]amino]propanoic acid
CID 124585096
2,2-dimethyl-3-[(1-methylsulfonylpyrrolidine-2-carbonyl)amino]propanoic acid
CID 81368766
(2S)-N-[(2R)-2-(dimethylamino)-3-methylbutyl]-1-methylsulfonylpiperidine-2-carboxamide
CID 94014919
1-methylsulfonyl-N-propan-2-yloxypyrrolidine-2-carboxamide
CID 154860289
N-(2-hydroxy-4-methylpentyl)-1-methylsulfonylpyrrolidine-2-carboxamide
CID 103771592
6-[(1-methylsulfonylpyrrolidine-2-carbonyl)amino]hexanoic acid
CID 43352987

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide (CID 47158071) is N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide is CS(=O)(=O)N1CCCC1C(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide?
The InChIKey is WWNXHADSVOJNHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3S/c1-16(14,15)12-6-2-3-9(12)10(13)11-7-8-4-5-8/h8-9H,2-7H2,1H3,(H,11,13).
What are the key properties of N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide?
N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide has a molecular weight of 246.33 g/mol, XLogP of -0.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide is sourced from PubChem (CID 47158071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).