5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine

C10H12BrNO — CID 144638458

IUPAC5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine
SMILESCc1cc(OCC2CC2)c(Br)cn1
InChIInChI=1S/C10H12BrNO/c1-7-4-10(9(11)5-12-7)13-6-8-2-3-8/h4-5,8H,2-3,6H2,1H3
InChIKeyLGCFGPGRRQNITM-UHFFFAOYSA-N
MW242.12 g/mol
LogP2.94
Rot. Bonds3

About 5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine

5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine (PubChem CID 144638458) has the molecular formula C10H12BrNO and a molecular weight of 242.12 g/mol. Its IUPAC name is 5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine.

Molecular Properties

Compound Name5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine
PubChem CID144638458
Molecular FormulaC10H12BrNO
Molecular Weight242.12 g/mol
Exact Mass241.01
IUPAC Name5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine
SMILESCc1cc(OCC2CC2)c(Br)cn1
InChIInChI=1S/C10H12BrNO/c1-7-4-10(9(11)5-12-7)13-6-8-2-3-8/h4-5,8H,2-3,6H2,1H3
InChIKeyLGCFGPGRRQNITM-UHFFFAOYSA-N
XLogP2.94
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.12
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-4-(cyclopentylmethoxy)pyridin-2-amine
CID 156580290
4-bromo-5-(cyclopropylmethoxy)-2-methylaniline
CID 121221486
4-bromo-3-(cyclopropylmethoxy)pyridine
CID 90156558
1-[4-(cyclopentylmethoxy)-6-methyl-3-pyridinyl]-N-methylmethanamine
CID 81250972
5-bromo-2-(cyclopentylmethoxy)-4-methylpyridine
CID 114870777
1-[4-bromo-3-(cyclopropylmethoxy)phenyl]propan-2-ol
CID 117459052
2-[4-bromo-3-(cyclopropylmethoxy)phenyl]acetonitrile
CID 84807749
3-bromo-4-(piperidin-4-ylmethoxy)pyridine
CID 104779217
N-[[4-(cyclohexylmethoxy)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 81253547
2-bromo-5-(cyclopropylmethoxy)-3-methoxypyridine
CID 90315250
4-[4-bromo-3-(cyclopropylmethoxy)phenyl]-4-hydroxybut-3-en-2-one
CID 125485318
(E)-3-[4-bromo-3-(cyclopropylmethoxy)phenyl]prop-2-en-1-amine
CID 117453223

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine?
The IUPAC name of 5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine (CID 144638458) is 5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine.
What is the SMILES notation for 5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine?
The canonical SMILES for 5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine is Cc1cc(OCC2CC2)c(Br)cn1.
What is the InChIKey of 5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine?
The InChIKey is LGCFGPGRRQNITM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrNO/c1-7-4-10(9(11)5-12-7)13-6-8-2-3-8/h4-5,8H,2-3,6H2,1H3.
What are the key properties of 5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine?
5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine has a molecular weight of 242.12 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine is sourced from PubChem (CID 144638458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).