[1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine

C10H13BrN2 — CID 130544931

IUPAC[1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine
SMILESCc1cc(C2(CN)CC2)ncc1Br
InChIInChI=1S/C10H13BrN2/c1-7-4-9(13-5-8(7)11)10(6-12)2-3-10/h4-5H,2-3,6,12H2,1H3
InChIKeyRSHFVVQYDJHIAV-UHFFFAOYSA-N
MW241.13 g/mol
LogP2.14
Rot. Bonds2

About [1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine

[1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine (PubChem CID 130544931) has the molecular formula C10H13BrN2 and a molecular weight of 241.13 g/mol. Its IUPAC name is [1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine
PubChem CID130544931
Molecular FormulaC10H13BrN2
Molecular Weight241.13 g/mol
Exact Mass240.03
IUPAC Name[1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine
SMILESCc1cc(C2(CN)CC2)ncc1Br
InChIInChI=1S/C10H13BrN2/c1-7-4-9(13-5-8(7)11)10(6-12)2-3-10/h4-5H,2-3,6,12H2,1H3
InChIKeyRSHFVVQYDJHIAV-UHFFFAOYSA-N
XLogP2.14
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.13
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(5-bromo-2-pyridinyl)cyclopropyl]methanamine;dihydrochloride
CID 169448349
[1-(5-methylpyridazin-3-yl)cyclopropyl]methanamine
CID 130544936
[1-(4-bromo-2,5-dimethylphenyl)cyclopentyl]methanamine
CID 84812408
[1-(5-ethyl-2-pyridinyl)cyclopropyl]methanamine
CID 115009121
5-bromo-4-methyl-2-[3-(trifluoromethyl)diazirin-3-yl]pyridine
CID 137346870
3-[1-(aminomethyl)cyclopropyl]-4-bromo-2,6-dimethylphenol
CID 117428377
2-[(5-bromo-4-methyl-2-pyridinyl)oxy]ethanamine
CID 114869805
[1-(6-bromo-2,3-dimethylphenyl)cyclopropyl]methanamine
CID 117388160
N'-(5-bromo-4-methyl-2-pyridinyl)butane-1,4-diamine
CID 114869070
[1-(5-bromo-4-methoxy-2-methylphenyl)cyclopropyl]methanamine
CID 117428385
N-(5-bromo-4-methyl-2-pyridinyl)-2,2-dimethylbutane-1,4-diamine
CID 106142320
5-bromo-4-methyl-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine
CID 114869282

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine?
The IUPAC name of [1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine (CID 130544931) is [1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine.
What is the SMILES notation for [1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine?
The canonical SMILES for [1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine is Cc1cc(C2(CN)CC2)ncc1Br.
What is the InChIKey of [1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine?
The InChIKey is RSHFVVQYDJHIAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2/c1-7-4-9(13-5-8(7)11)10(6-12)2-3-10/h4-5H,2-3,6,12H2,1H3.
What are the key properties of [1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine?
[1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine has a molecular weight of 241.13 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromo-4-methyl-2-pyridinyl)cyclopropyl]methanamine is sourced from PubChem (CID 130544931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).