4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide

C10H13BrN2O — CID 62408030

IUPAC4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide
SMILESCC1CC1NC(=O)c1cc(Br)cn1C
InChIInChI=1S/C10H13BrN2O/c1-6-3-8(6)12-10(14)9-4-7(11)5-13(9)2/h4-6,8H,3H2,1-2H3,(H,12,14)
InChIKeyAUKGGFONYMDWSV-UHFFFAOYSA-N
MW257.13 g/mol
LogP1.93
Rot. Bonds2

About 4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide

4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide (PubChem CID 62408030) has the molecular formula C10H13BrN2O and a molecular weight of 257.13 g/mol. Its IUPAC name is 4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide
PubChem CID62408030
Molecular FormulaC10H13BrN2O
Molecular Weight257.13 g/mol
Exact Mass256.02
IUPAC Name4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide
SMILESCC1CC1NC(=O)c1cc(Br)cn1C
InChIInChI=1S/C10H13BrN2O/c1-6-3-8(6)12-10(14)9-4-7(11)5-13(9)2/h4-6,8H,3H2,1-2H3,(H,12,14)
InChIKeyAUKGGFONYMDWSV-UHFFFAOYSA-N
XLogP1.93
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.13
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-N-(2-methylcyclopropyl)-1-propylpyrrole-2-carboxamide
CID 62408221
4-bromo-N-(2-methylcyclopropyl)-1-propan-2-ylpyrrole-2-carboxamide
CID 62408223
4-bromo-N-(1,2-dimethylpiperidin-4-yl)-1-methylpyrrole-2-carboxamide
CID 79036256
1-methyl-5-[(2-methylcyclopropyl)carbamoyl]pyrrole-3-sulfonyl chloride
CID 65367382
4-bromo-N-(3-methoxycyclobutyl)-1-methylpyrrole-2-carboxamide
CID 104578412
4-bromo-1-methyl-N-pyrrolidin-3-ylpyrrole-2-carboxamide
CID 62379331
4-bromo-N-(4-ethylcyclohexyl)-1-methylpyrrole-2-carboxamide
CID 61244506
4-bromo-1-methyl-N-(5-oxopyrrolidin-3-yl)pyrrole-2-carboxamide
CID 103954038
4-bromo-N-(2,3-dimethylcyclopentyl)-1-propan-2-ylpyrrole-2-carboxamide
CID 64908073
4-bromo-1-methyl-N-(4-methylpiperazin-1-yl)pyrrole-2-carboxamide
CID 115279131
4-bromo-1-methyl-N-(1-methylcyclopropyl)pyrrole-2-carboxamide
CID 115634355
4-bromo-N-(1-butylpiperidin-4-yl)-1-methylpyrrole-2-carboxamide
CID 60956390

Frequently Asked Questions

What is the IUPAC name of 4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide?
The IUPAC name of 4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide (CID 62408030) is 4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide.
What is the SMILES notation for 4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide?
The canonical SMILES for 4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide is CC1CC1NC(=O)c1cc(Br)cn1C.
What is the InChIKey of 4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide?
The InChIKey is AUKGGFONYMDWSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2O/c1-6-3-8(6)12-10(14)9-4-7(11)5-13(9)2/h4-6,8H,3H2,1-2H3,(H,12,14).
What are the key properties of 4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide?
4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide has a molecular weight of 257.13 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-1-methyl-N-(2-methylcyclopropyl)pyrrole-2-carboxamide is sourced from PubChem (CID 62408030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).