N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide

C18H24N4O — CID 91796198

IUPACN-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide
SMILESCc1cnc(C(C)NC(=O)c2ccc(N3CCCCC3)cc2)[nH]1
InChIInChI=1S/C18H24N4O/c1-13-12-19-17(20-13)14(2)21-18(23)15-6-8-16(9-7-15)22-10-4-3-5-11-22/h6-9,12,14H,3-5,10-11H2,1-2H3,(H,19,20)(H,21,23)
InChIKeyFXFIZPODADWJLW-UHFFFAOYSA-N
MW312.42 g/mol
LogP3.20
Rot. Bonds4

About N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide

N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide (PubChem CID 91796198) has the molecular formula C18H24N4O and a molecular weight of 312.42 g/mol. Its IUPAC name is N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide.

Molecular Properties

Compound NameN-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide
PubChem CID91796198
Molecular FormulaC18H24N4O
Molecular Weight312.42 g/mol
Exact Mass312.20
IUPAC NameN-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide
SMILESCc1cnc(C(C)NC(=O)c2ccc(N3CCCCC3)cc2)[nH]1
InChIInChI=1S/C18H24N4O/c1-13-12-19-17(20-13)14(2)21-18(23)15-6-8-16(9-7-15)22-10-4-3-5-11-22/h6-9,12,14H,3-5,10-11H2,1-2H3,(H,19,20)(H,21,23)
InChIKeyFXFIZPODADWJLW-UHFFFAOYSA-N
XLogP3.20
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R)-1-(5-methyl-1H-imidazol-2-yl)propyl]-4-pyrrolidin-1-ylbenzamide
CID 99972095
N-[(1S)-1-(4-fluorophenyl)ethyl]-4-piperidin-1-ylbenzamide
CID 28636051
N-[(1R)-1-(5-methyl-1H-imidazol-2-yl)ethyl]-3-(2-oxoimidazolidin-1-yl)benzamide
CID 125442654
N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-1-pyrrolidin-1-ylcyclohexane-1-carboxamide
CID 91794714
4-[(5-oxo-4H-1,2,4-triazin-3-yl)amino]-N-[1-(4-piperidin-1-ylphenyl)ethyl]benzamide
CID 136671359
N-[(1R)-1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-(tetrazol-1-ylmethyl)benzamide
CID 125438716
N-[1-(4-methoxyphenyl)ethyl]-4-piperidin-1-ylbenzamide
CID 43910482
4-methoxy-N-[(1S)-1-(5-methyl-1H-imidazol-2-yl)ethyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide
CID 97283103
N-(1-phenylethyl)-6-(4-pyrrolidin-1-ylanilino)pyridine-3-carboxamide
CID 109156245
2-(azepan-1-yl)-N-(1-phenylethyl)pyrimidine-5-carboxamide
CID 109256389
N-[(R)-(2-methylphenyl)-phenylmethyl]-4-piperidin-1-ylbenzamide
CID 93487464
2-(azepan-1-yl)-N-propan-2-ylpyrimidine-5-carboxamide
CID 109246951

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide?
The IUPAC name of N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide (CID 91796198) is N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide.
What is the SMILES notation for N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide?
The canonical SMILES for N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide is Cc1cnc(C(C)NC(=O)c2ccc(N3CCCCC3)cc2)[nH]1.
What is the InChIKey of N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide?
The InChIKey is FXFIZPODADWJLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O/c1-13-12-19-17(20-13)14(2)21-18(23)15-6-8-16(9-7-15)22-10-4-3-5-11-22/h6-9,12,14H,3-5,10-11H2,1-2H3,(H,19,20)(H,21,23).
What are the key properties of N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide?
N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide has a molecular weight of 312.42 g/mol, XLogP of 3.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]-4-piperidin-1-ylbenzamide is sourced from PubChem (CID 91796198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).