5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine

C18H24N4 — CID 153288688

IUPAC5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESc1nc2c([nH]1)CN(Cc1ccc(N3CCCCC3)cc1)CC2
InChIInChI=1S/C18H24N4/c1-2-9-22(10-3-1)16-6-4-15(5-7-16)12-21-11-8-17-18(13-21)20-14-19-17/h4-7,14H,1-3,8-13H2,(H,19,20)
InChIKeyQWEWJLHLCFZDMD-UHFFFAOYSA-N
MW296.42 g/mol
LogP2.96
Rot. Bonds3

About 5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine

5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 153288688) has the molecular formula C18H24N4 and a molecular weight of 296.42 g/mol. Its IUPAC name is 5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID153288688
Molecular FormulaC18H24N4
Molecular Weight296.42 g/mol
Exact Mass296.20
IUPAC Name5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESc1nc2c([nH]1)CN(Cc1ccc(N3CCCCC3)cc1)CC2
InChIInChI=1S/C18H24N4/c1-2-9-22(10-3-1)16-6-4-15(5-7-16)12-21-11-8-17-18(13-21)20-14-19-17/h4-7,14H,1-3,8-13H2,(H,19,20)
InChIKeyQWEWJLHLCFZDMD-UHFFFAOYSA-N
XLogP2.96
TPSA35.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

[2-amino-4-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)pyrimidin-5-yl]-dimethyl-[4-(piperidin-1-ylmethyl)phenyl]azanium
CID 68748883
2-propyl-6-[(4-pyrrolidin-1-ylphenyl)methyl]-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135919272
6-[(4-pyrrolidin-1-ylphenyl)methyl]-2-(2,3,4,5-tetrahydropyridin-6-yl)-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135919268
5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 72929431
2-(furan-2-yl)-6-[(4-piperidin-1-ylphenyl)methyl]-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135919254
N-(oxolan-2-ylmethyl)-5-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-ylmethyl)pyrimidin-2-amine
CID 72887651
2-pyridin-4-yl-7-[(4-pyrrolidin-1-ylphenyl)methyl]-3,5,6,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
CID 136681205
3,5-dimethyl-2-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-ylmethyl)-1H-pyridin-4-one
CID 91828745
3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbaldehyde
CID 12037662
1,16-diazatricyclo[14.14.4.231,34]hexatriaconta-31,33,35-triene
CID 177496449
4-[(4-pyrrolidin-1-ylphenyl)methyl]-1,4-thiazinane 1,1-dioxide
CID 168512730
1-(4-fluorophenyl)-4-[(4-fluorophenyl)methyl]-1,4-diazepane
CID 87015648

Frequently Asked Questions

What is the IUPAC name of 5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 153288688) is 5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine is c1nc2c([nH]1)CN(Cc1ccc(N3CCCCC3)cc1)CC2.
What is the InChIKey of 5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is QWEWJLHLCFZDMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4/c1-2-9-22(10-3-1)16-6-4-15(5-7-16)12-21-11-8-17-18(13-21)20-14-19-17/h4-7,14H,1-3,8-13H2,(H,19,20).
What are the key properties of 5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 296.42 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 153288688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).