2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine

C10H12INO — CID 156612397

IUPAC2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine
SMILESCc1c(I)ccnc1OCC1CC1
InChIInChI=1S/C10H12INO/c1-7-9(11)4-5-12-10(7)13-6-8-2-3-8/h4-5,8H,2-3,6H2,1H3
InChIKeySSRKGYFGJOBMHS-UHFFFAOYSA-N
MW289.12 g/mol
LogP2.78
Rot. Bonds3

About 2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine

2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine (PubChem CID 156612397) has the molecular formula C10H12INO and a molecular weight of 289.12 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine
PubChem CID156612397
Molecular FormulaC10H12INO
Molecular Weight289.12 g/mol
Exact Mass289.00
IUPAC Name2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine
SMILESCc1c(I)ccnc1OCC1CC1
InChIInChI=1S/C10H12INO/c1-7-9(11)4-5-12-10(7)13-6-8-2-3-8/h4-5,8H,2-3,6H2,1H3
InChIKeySSRKGYFGJOBMHS-UHFFFAOYSA-N
XLogP2.78
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.12
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-(cyclopropylmethoxy)-3-propan-2-ylpyridine
CID 164786458
[2-(cyclopropylmethoxy)-3-fluoro-4-pyridinyl]methanol
CID 105383342
4-(cyclopropylmethoxy)-3-methoxy-2-methylpyridine
CID 10535781
1-(cyclopropylmethoxy)-2-iodobenzene
CID 61400120
2-(cyclopropylmethoxy)-3-(difluoromethoxy)-6-iodopyridine
CID 87454075
cyclopropylmethanol;2-(cyclopropylmethoxy)-6-iodo-3-methoxypyridine
CID 159114657
N-[[2-(cyclopropylmethoxy)-3-pyridinyl]methyl]propan-1-amine
CID 62292023
4-(cyclopropylmethoxy)-5-methoxy-6-methylpyrimidine
CID 129261235
2-bromo-4-iodo-3-methylpyridine
CID 119024752
2-methyl-3-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methoxy]pyrazine
CID 165434594
6-(cyclohexylmethoxy)-N-ethyl-5-methylpyrimidin-4-amine
CID 80880319
2-(piperidin-4-ylmethoxy)pyridin-3-ol
CID 71646429

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine?
The IUPAC name of 2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine (CID 156612397) is 2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine?
The canonical SMILES for 2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine is Cc1c(I)ccnc1OCC1CC1.
What is the InChIKey of 2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine?
The InChIKey is SSRKGYFGJOBMHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12INO/c1-7-9(11)4-5-12-10(7)13-6-8-2-3-8/h4-5,8H,2-3,6H2,1H3.
What are the key properties of 2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine?
2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine has a molecular weight of 289.12 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-4-iodo-3-methylpyridine is sourced from PubChem (CID 156612397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).