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

C9H10BrN3O — CID 65466775

IUPAC1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide
SMILESNC1(C(=O)Nc2ccc(Br)cn2)CC1
InChIInChI=1S/C9H10BrN3O/c10-6-1-2-7(12-5-6)13-8(14)9(11)3-4-9/h1-2,5H,3-4,11H2,(H,12,13,14)
InChIKeyMSWPWQNXPCWANM-UHFFFAOYSA-N
MW256.10 g/mol
LogP1.27
Rot. Bonds2

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

1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide (PubChem CID 65466775) has the molecular formula C9H10BrN3O and a molecular weight of 256.10 g/mol. Its IUPAC name is 1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide
PubChem CID65466775
Molecular FormulaC9H10BrN3O
Molecular Weight256.10 g/mol
Exact Mass255.00
IUPAC Name1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide
SMILESNC1(C(=O)Nc2ccc(Br)cn2)CC1
InChIInChI=1S/C9H10BrN3O/c10-6-1-2-7(12-5-6)13-8(14)9(11)3-4-9/h1-2,5H,3-4,11H2,(H,12,13,14)
InChIKeyMSWPWQNXPCWANM-UHFFFAOYSA-N
XLogP1.27
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.10
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide
CID 64684559
1-amino-N-(5-bromo-4-methyl-2-pyridinyl)cyclopropane-1-carboxamide
CID 79734115
2-(4-bromophenyl)-N-(5-bromo-2-pyridinyl)acetamide
CID 29260244
1-amino-N-[2-[(5-bromo-2-pyridinyl)amino]-2-oxoethyl]-N-methylcyclohexane-1-carboxamide
CID 119875009
1-amino-N-(2,5-dibromophenyl)cyclopropane-1-carboxamide
CID 65465089
N-(5-bromo-2-pyridinyl)-2-methylpropanamide
CID 14988412
N-(5-bromo-2-pyridinyl)-1-cyano-3-methylcyclobutane-1-carboxamide
CID 80501510
1-amino-N-(5-piperidin-1-yl-2-pyridinyl)cyclohexane-1-carboxamide
CID 119855685
2-amino-N-(5-bromo-2-pyridinyl)benzamide
CID 13348356
1-(1-aminocyclopentanecarbonyl)-N-(5-bromo-2-pyridinyl)piperidine-4-carboxamide;dihydrochloride
CID 119856436
cis-(1S,2R)-N-(5-bromo-2-pyridinyl)-2-methylcyclopropane-1-carboxamide
CID 42564426
4-[(5-bromo-2-pyridinyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103498673

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide (CID 65466775) is 1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide is NC1(C(=O)Nc2ccc(Br)cn2)CC1.
What is the InChIKey of 1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide?
The InChIKey is MSWPWQNXPCWANM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrN3O/c10-6-1-2-7(12-5-6)13-8(14)9(11)3-4-9/h1-2,5H,3-4,11H2,(H,12,13,14).
What are the key properties of 1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide?
1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide has a molecular weight of 256.10 g/mol, XLogP of 1.27, 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-2-pyridinyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 65466775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).