4-(propan-2-yloxymethyl)pyridine

C9H13NO — CID 14442204

IUPAC4-(propan-2-yloxymethyl)pyridine
SMILESCC(C)OCc1ccncc1
InChIInChI=1S/C9H13NO/c1-8(2)11-7-9-3-5-10-6-4-9/h3-6,8H,7H2,1-2H3
InChIKeyAHADSCLYQBGFAM-UHFFFAOYSA-N
MW151.21 g/mol
LogP2.01
Rot. Bonds3

About 4-(propan-2-yloxymethyl)pyridine

4-(propan-2-yloxymethyl)pyridine (PubChem CID 14442204) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 4-(propan-2-yloxymethyl)pyridine.

Molecular Properties

Compound Name4-(propan-2-yloxymethyl)pyridine
PubChem CID14442204
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name4-(propan-2-yloxymethyl)pyridine
SMILESCC(C)OCc1ccncc1
InChIInChI=1S/C9H13NO/c1-8(2)11-7-9-3-5-10-6-4-9/h3-6,8H,7H2,1-2H3
InChIKeyAHADSCLYQBGFAM-UHFFFAOYSA-N
XLogP2.01
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(pentan-2-yloxymethyl)pyridine
CID 59678333
N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine
CID 62335696
1-(methoxymethyl)-4-(propan-2-yloxymethyl)benzene
CID 70670788
methyl 2-(pyridin-4-ylmethoxy)propanoate
CID 83213951
1-chloro-4-(propan-2-yloxymethyl)benzene
CID 23548339
N-(2-propan-2-yloxyethyl)-2-pyridin-4-ylethanamine
CID 61485275
N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine
CID 79573917
trimethyl(pyridin-4-ylmethoxy)silane
CID 45117506
propan-2-yl 2-(pyridin-4-ylmethoxy)acetate
CID 83213799
4-(propan-2-yloxymethyl)benzonitrile
CID 15647231
N-(pyridin-4-ylmethoxy)methanamine
CID 87262654
3-propan-2-yloxy-N-(pyridin-4-ylmethyl)propan-1-amine;hydrochloride
CID 17206477

Frequently Asked Questions

What is the IUPAC name of 4-(propan-2-yloxymethyl)pyridine?
The IUPAC name of 4-(propan-2-yloxymethyl)pyridine (CID 14442204) is 4-(propan-2-yloxymethyl)pyridine.
What is the SMILES notation for 4-(propan-2-yloxymethyl)pyridine?
The canonical SMILES for 4-(propan-2-yloxymethyl)pyridine is CC(C)OCc1ccncc1.
What is the InChIKey of 4-(propan-2-yloxymethyl)pyridine?
The InChIKey is AHADSCLYQBGFAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-8(2)11-7-9-3-5-10-6-4-9/h3-6,8H,7H2,1-2H3.
What are the key properties of 4-(propan-2-yloxymethyl)pyridine?
4-(propan-2-yloxymethyl)pyridine has a molecular weight of 151.21 g/mol, XLogP of 2.01, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(propan-2-yloxymethyl)pyridine is sourced from PubChem (CID 14442204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).