4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide

C22H24N4O — CID 60526309

IUPAC4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide
SMILESO=C(NCc1ccnc(-n2ccnc2)c1)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C22H24N4O/c27-22(20-8-6-19(7-9-20)18-4-2-1-3-5-18)25-15-17-10-11-24-21(14-17)26-13-12-23-16-26/h6-14,16,18H,1-5,15H2,(H,25,27)
InChIKeyDSZOIWQBQDAKKS-UHFFFAOYSA-N
MW360.46 g/mol
LogP4.24
Rot. Bonds5

About 4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide

4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide (PubChem CID 60526309) has the molecular formula C22H24N4O and a molecular weight of 360.46 g/mol. Its IUPAC name is 4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide
PubChem CID60526309
Molecular FormulaC22H24N4O
Molecular Weight360.46 g/mol
Exact Mass360.20
IUPAC Name4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide
SMILESO=C(NCc1ccnc(-n2ccnc2)c1)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C22H24N4O/c27-22(20-8-6-19(7-9-20)18-4-2-1-3-5-18)25-15-17-10-11-24-21(14-17)26-13-12-23-16-26/h6-14,16,18H,1-5,15H2,(H,25,27)
InChIKeyDSZOIWQBQDAKKS-UHFFFAOYSA-N
XLogP4.24
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-hydroxycyclohexyl)-3-[(2-imidazol-1-yl-4-pyridinyl)methyl]urea
CID 110933396
(2R)-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]piperidine-2-carboxamide
CID 119859955
1-[(1S,2S)-2-cyclohexylcyclopropyl]-3-[(2-imidazol-1-yl-4-pyridinyl)methyl]urea
CID 95933124
(1S)-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]cyclohex-3-ene-1-carboxamide
CID 94565002
2-(cyclopropylmethylamino)-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]acetamide;dihydrochloride
CID 119859974
3-(2,5-dioxopyrrolidin-1-yl)-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide
CID 167917933
N-[(2-imidazol-1-yl-4-pyridinyl)methyl]-1,3-thiazole-4-carboxamide
CID 136523432
2-imidazol-1-yl-N-[(4-pyrrolidin-1-ylphenyl)methyl]pyridine-4-carboxamide
CID 51085922
2-imidazol-1-yl-N-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide
CID 51085856
1-[(2-hydroxycyclopentyl)methyl]-3-[(2-imidazol-1-yl-4-pyridinyl)methyl]-1-methylurea
CID 109398554
N-[(2-imidazol-1-yl-4-pyridinyl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 56816401
N-[(2-imidazol-1-yl-4-pyridinyl)methyl]-9-methyl-3,9-diazabicyclo[4.2.1]nonane-3-carboxamide
CID 71868402

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide?
The IUPAC name of 4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide (CID 60526309) is 4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide.
What is the SMILES notation for 4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide?
The canonical SMILES for 4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide is O=C(NCc1ccnc(-n2ccnc2)c1)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of 4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide?
The InChIKey is DSZOIWQBQDAKKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O/c27-22(20-8-6-19(7-9-20)18-4-2-1-3-5-18)25-15-17-10-11-24-21(14-17)26-13-12-23-16-26/h6-14,16,18H,1-5,15H2,(H,25,27).
What are the key properties of 4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide?
4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide has a molecular weight of 360.46 g/mol, XLogP of 4.24, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]benzamide is sourced from PubChem (CID 60526309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).