2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

C15H23N3O — CID 64859332

IUPAC2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESC1CCC(Cn2c(C3CC3)nc3c2CCNC3)OC1
InChIInChI=1S/C15H23N3O/c1-2-8-19-12(3-1)10-18-14-6-7-16-9-13(14)17-15(18)11-4-5-11/h11-12,16H,1-10H2
InChIKeyZRZOMJMLEUZQND-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.98
Rot. Bonds3

About 2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 64859332) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID64859332
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESC1CCC(Cn2c(C3CC3)nc3c2CCNC3)OC1
InChIInChI=1S/C15H23N3O/c1-2-8-19-12(3-1)10-18-14-6-7-16-9-13(14)17-15(18)11-4-5-11/h11-12,16H,1-10H2
InChIKeyZRZOMJMLEUZQND-UHFFFAOYSA-N
XLogP1.98
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopentyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856641
2-methyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64859333
2-cyclopentyl-1-[2-(oxolan-2-yl)ethyl]-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858788
2-cyclopropyl-1-(cyclopropylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857490
2-cyclopentyl-1-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856436
2-cyclopropyl-1-[(1-methylpiperidin-2-yl)methyl]-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858154
2-cyclopentyl-1-[(2-methylcyclopentyl)methyl]-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 107420835
2-cyclopentyl-1-(2-pyrrolidin-1-ylethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856637
2-cyclopropyl-1-(3-pyrrolidin-1-ylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857561
2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-N,N-dimethylacetamide
CID 64856440
1-butyl-2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858865
2-cyclopentyl-1-(2,2,3,3-tetrafluoropropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 106294106

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 64859332) is 2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is C1CCC(Cn2c(C3CC3)nc3c2CCNC3)OC1.
What is the InChIKey of 2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is ZRZOMJMLEUZQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-8-19-12(3-1)10-18-14-6-7-16-9-13(14)17-15(18)11-4-5-11/h11-12,16H,1-10H2.
What are the key properties of 2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 261.37 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(oxan-2-ylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 64859332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).