1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

C17H23N3O — CID 64857230

IUPAC1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCCC(COC)n1c(-c2ccccc2)nc2c1CCNC2
InChIInChI=1S/C17H23N3O/c1-3-14(12-21-2)20-16-9-10-18-11-15(16)19-17(20)13-7-5-4-6-8-13/h4-8,14,18H,3,9-12H2,1-2H3
InChIKeyZDGCEVVEVMQOLB-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.79
Rot. Bonds5

About 1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 64857230) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID64857230
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCCC(COC)n1c(-c2ccccc2)nc2c1CCNC2
InChIInChI=1S/C17H23N3O/c1-3-14(12-21-2)20-16-9-10-18-11-15(16)19-17(20)13-7-5-4-6-8-13/h4-8,14,18H,3,9-12H2,1-2H3
InChIKeyZDGCEVVEVMQOLB-UHFFFAOYSA-N
XLogP2.79
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine with MolForge

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Related Compounds

1-pentan-2-yl-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858976
1-(3-methoxy-2-methylpropyl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858590
2-cyclopropyl-1-(1-methoxybutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858571
N,N-dimethyl-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-amine
CID 83025118
1-hexan-3-yl-2-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857342
1,2-diphenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856821
2-tert-butyl-1-(3-methylpentan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64859335
N,N-dimethyl-3-(2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propan-1-amine
CID 64857800
1-cyclobutyl-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857417
N-[(2S)-1-methoxypropan-2-yl]-2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine
CID 95727447
2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857941
1-(1-ethoxypropan-2-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858742

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 64857230) is 1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is CCC(COC)n1c(-c2ccccc2)nc2c1CCNC2.
What is the InChIKey of 1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is ZDGCEVVEVMQOLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-3-14(12-21-2)20-16-9-10-18-11-15(16)19-17(20)13-7-5-4-6-8-13/h4-8,14,18H,3,9-12H2,1-2H3.
What are the key properties of 1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 285.39 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxybutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 64857230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).