4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide

C11H18N4O — CID 61461789

IUPAC4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide
SMILESCN1CCC(NC(=O)c2cc(N)cn2C)C1
InChIInChI=1S/C11H18N4O/c1-14-4-3-9(7-14)13-11(16)10-5-8(12)6-15(10)2/h5-6,9H,3-4,7,12H2,1-2H3,(H,13,16)
InChIKeyQVQSLJJQNFJVTG-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.04
Rot. Bonds2

About 4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide

4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide (PubChem CID 61461789) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide
PubChem CID61461789
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide
SMILESCN1CCC(NC(=O)c2cc(N)cn2C)C1
InChIInChI=1S/C11H18N4O/c1-14-4-3-9(7-14)13-11(16)10-5-8(12)6-15(10)2/h5-6,9H,3-4,7,12H2,1-2H3,(H,13,16)
InChIKeyQVQSLJJQNFJVTG-UHFFFAOYSA-N
XLogP0.04
TPSA63.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-1-methyl-N-(1-methylpiperidin-4-yl)pyrrole-2-carboxamide
CID 43643546
4-amino-1-cyclopropyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide
CID 54949762
4-amino-1-methyl-N-(4-methylcyclohexyl)pyrrole-2-carboxamide
CID 43642107
4-amino-1-methyl-N-(1-methylsulfonylpiperidin-4-yl)pyrrole-2-carboxamide
CID 43644159
2,4-diamino-N-(1-methylpyrrolidin-3-yl)benzamide
CID 54949912
4-amino-1-methyl-N-(5-oxopyrrolidin-3-yl)pyrrole-2-carboxamide
CID 106179845
5-amino-2-chloro-N-(1-methylpyrrolidin-3-yl)benzamide
CID 54949514
3,5-diamino-N-(1-methylpiperidin-4-yl)benzamide
CID 61094399
4-amino-3,5-difluoro-N-(1-methylpyrrolidin-3-yl)benzamide
CID 63185966
N-cyclopropyl-4-iodo-1-methylpyrrole-2-carboxamide
CID 168679995
3,5-difluoro-N-(1-methylpyrrolidin-3-yl)benzamide
CID 110473062
2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide
CID 167763974

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide?
The IUPAC name of 4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide (CID 61461789) is 4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide?
The canonical SMILES for 4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide is CN1CCC(NC(=O)c2cc(N)cn2C)C1.
What is the InChIKey of 4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide?
The InChIKey is QVQSLJJQNFJVTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-14-4-3-9(7-14)13-11(16)10-5-8(12)6-15(10)2/h5-6,9H,3-4,7,12H2,1-2H3,(H,13,16).
What are the key properties of 4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide?
4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 0.04, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide is sourced from PubChem (CID 61461789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).