N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide

C10H14N2OS — CID 71640939

IUPACN-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide
SMILESCN(C(=O)c1cccs1)[C@@H]1CCNC1
InChIInChI=1S/C10H14N2OS/c1-12(8-4-5-11-7-8)10(13)9-3-2-6-14-9/h2-3,6,8,11H,4-5,7H2,1H3/t8-/m1/s1
InChIKeyCIFNLYFAYUOYGM-MRVPVSSYSA-N
MW210.30 g/mol
LogP1.18
Rot. Bonds2

About N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide

N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide (PubChem CID 71640939) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide
PubChem CID71640939
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC NameN-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide
SMILESCN(C(=O)c1cccs1)[C@@H]1CCNC1
InChIInChI=1S/C10H14N2OS/c1-12(8-4-5-11-7-8)10(13)9-3-2-6-14-9/h2-3,6,8,11H,4-5,7H2,1H3/t8-/m1/s1
InChIKeyCIFNLYFAYUOYGM-MRVPVSSYSA-N
XLogP1.18
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide?
The IUPAC name of N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide (CID 71640939) is N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide.
What is the SMILES notation for N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide?
The canonical SMILES for N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide is CN(C(=O)c1cccs1)[C@@H]1CCNC1.
What is the InChIKey of N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide?
The InChIKey is CIFNLYFAYUOYGM-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H14N2OS/c1-12(8-4-5-11-7-8)10(13)9-3-2-6-14-9/h2-3,6,8,11H,4-5,7H2,1H3/t8-/m1/s1.
What are the key properties of N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide?
N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide has a molecular weight of 210.30 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(3R)-pyrrolidin-3-yl]thiophene-2-carboxamide is sourced from PubChem (CID 71640939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).