3-bromo-N-cyclopropyl-4-methylpyridin-2-amine

C9H11BrN2 — CID 97181175

IUPAC3-bromo-N-cyclopropyl-4-methylpyridin-2-amine
SMILESCc1ccnc(NC2CC2)c1Br
InChIInChI=1S/C9H11BrN2/c1-6-4-5-11-9(8(6)10)12-7-2-3-7/h4-5,7H,2-3H2,1H3,(H,11,12)
InChIKeyRCCUXQAKKVIHDZ-UHFFFAOYSA-N
MW227.10 g/mol
LogP2.73
Rot. Bonds2

About 3-bromo-N-cyclopropyl-4-methylpyridin-2-amine

3-bromo-N-cyclopropyl-4-methylpyridin-2-amine (PubChem CID 97181175) has the molecular formula C9H11BrN2 and a molecular weight of 227.10 g/mol. Its IUPAC name is 3-bromo-N-cyclopropyl-4-methylpyridin-2-amine.

Molecular Properties

Compound Name3-bromo-N-cyclopropyl-4-methylpyridin-2-amine
PubChem CID97181175
Molecular FormulaC9H11BrN2
Molecular Weight227.10 g/mol
Exact Mass226.01
IUPAC Name3-bromo-N-cyclopropyl-4-methylpyridin-2-amine
SMILESCc1ccnc(NC2CC2)c1Br
InChIInChI=1S/C9H11BrN2/c1-6-4-5-11-9(8(6)10)12-7-2-3-7/h4-5,7H,2-3H2,1H3,(H,11,12)
InChIKeyRCCUXQAKKVIHDZ-UHFFFAOYSA-N
XLogP2.73
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.10
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-4-methyl-N-pyrrolidin-3-ylpyridin-2-amine
CID 106876094
5-[(3-bromo-4-methyl-2-pyridinyl)amino]piperidin-2-one
CID 106875729
3-bromo-N-(1-cyclopropylethyl)-4-methylpyridin-2-amine
CID 106875494
3-bromo-N-(2,3-dimethylcyclohexyl)-4-methylpyridin-2-amine
CID 106875451
3-bromo-4-methyl-N-(pyrrolidin-3-ylmethyl)pyridin-2-amine
CID 106876197
3-bromo-N-tert-butyl-4-methylpyridin-2-amine
CID 106876455
3-bromo-N-(3-chloro-2,2-dimethylcyclobutyl)-4-methylpyridin-2-amine
CID 106879069
3-bromo-4-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine
CID 106875473
3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 106876097
3-bromo-N-[(4S)-4-methoxypyrrolidin-3-yl]-4-methylpyridin-2-amine
CID 106876065
3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine
CID 106875940
3-bromo-4-methyl-N-(2,3,4,5,6-pentafluorophenyl)pyridin-2-amine
CID 106877354

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-cyclopropyl-4-methylpyridin-2-amine?
The IUPAC name of 3-bromo-N-cyclopropyl-4-methylpyridin-2-amine (CID 97181175) is 3-bromo-N-cyclopropyl-4-methylpyridin-2-amine.
What is the SMILES notation for 3-bromo-N-cyclopropyl-4-methylpyridin-2-amine?
The canonical SMILES for 3-bromo-N-cyclopropyl-4-methylpyridin-2-amine is Cc1ccnc(NC2CC2)c1Br.
What is the InChIKey of 3-bromo-N-cyclopropyl-4-methylpyridin-2-amine?
The InChIKey is RCCUXQAKKVIHDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrN2/c1-6-4-5-11-9(8(6)10)12-7-2-3-7/h4-5,7H,2-3H2,1H3,(H,11,12).
What are the key properties of 3-bromo-N-cyclopropyl-4-methylpyridin-2-amine?
3-bromo-N-cyclopropyl-4-methylpyridin-2-amine has a molecular weight of 227.10 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-cyclopropyl-4-methylpyridin-2-amine is sourced from PubChem (CID 97181175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).