1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide

C10H12BrN3O — CID 79734115

IUPAC1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide
SMILESCc1cc(NC(=O)C2(N)CC2)ncc1Br
InChIInChI=1S/C10H12BrN3O/c1-6-4-8(13-5-7(6)11)14-9(15)10(12)2-3-10/h4-5H,2-3,12H2,1H3,(H,13,14,15)
InChIKeyCAVWUJAEVSLEQZ-UHFFFAOYSA-N
MW270.13 g/mol
LogP1.58
Rot. Bonds2

About 1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide

1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide (PubChem CID 79734115) has the molecular formula C10H12BrN3O and a molecular weight of 270.13 g/mol. Its IUPAC name is 1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide
PubChem CID79734115
Molecular FormulaC10H12BrN3O
Molecular Weight270.13 g/mol
Exact Mass269.02
IUPAC Name1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide
SMILESCc1cc(NC(=O)C2(N)CC2)ncc1Br
InChIInChI=1S/C10H12BrN3O/c1-6-4-8(13-5-7(6)11)14-9(15)10(12)2-3-10/h4-5H,2-3,12H2,1H3,(H,13,14,15)
InChIKeyCAVWUJAEVSLEQZ-UHFFFAOYSA-N
XLogP1.58
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.13
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-4-methyl-2-pyridinyl)-1-carbamothioylcyclopropane-1-carboxamide
CID 80590582
2-(1-aminocyclopentyl)-N-(5-bromo-4-methyl-2-pyridinyl)acetamide
CID 79734126
2-bromo-N-(5-bromo-4-methyl-2-pyridinyl)acetamide
CID 79734217
(2S)-2-amino-N-(5-bromo-4-methyl-2-pyridinyl)propanamide
CID 79734122
5-bromo-4-methylpyridin-2-amine;N-(5-bromo-4-methyl-2-pyridinyl)acetamide
CID 162076548
N-(5-bromo-4-methyl-2-pyridinyl)-3-ethylpyrrolidine-3-carboxamide
CID 79734509
1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide
CID 65466775
1-amino-N-(4-bromo-3-methylphenyl)cyclopropane-1-carboxamide;hydrochloride
CID 119673461
3,5-diamino-N-(5-bromo-4-methyl-2-pyridinyl)benzamide
CID 79734210
N-(5-bromo-4-methyl-2-pyridinyl)-3-propylpyrrolidine-3-carboxamide
CID 79734821
4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-3-methylbenzamide
CID 79733791
3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide
CID 79734420

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide (CID 79734115) is 1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide is Cc1cc(NC(=O)C2(N)CC2)ncc1Br.
What is the InChIKey of 1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide?
The InChIKey is CAVWUJAEVSLEQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrN3O/c1-6-4-8(13-5-7(6)11)14-9(15)10(12)2-3-10/h4-5H,2-3,12H2,1H3,(H,13,14,15).
What are the key properties of 1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide?
1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide has a molecular weight of 270.13 g/mol, XLogP of 1.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 79734115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).