(2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide

C18H24N4O2 — CID 95291018

IUPAC(2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide
SMILESCOc1ccc(N2CCC(NC(=O)[C@@H](C)n3ccnc3)CC2)cc1
InChIInChI=1S/C18H24N4O2/c1-14(22-12-9-19-13-22)18(23)20-15-7-10-21(11-8-15)16-3-5-17(24-2)6-4-16/h3-6,9,12-15H,7-8,10-11H2,1-2H3,(H,20,23)/t14-/m1/s1
InChIKeyXENDGCBVEILHER-CQSZACIVSA-N
MW328.42 g/mol
LogP2.24
Rot. Bonds5

About (2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide

(2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide (PubChem CID 95291018) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is (2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound Name(2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide
PubChem CID95291018
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC Name(2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide
SMILESCOc1ccc(N2CCC(NC(=O)[C@@H](C)n3ccnc3)CC2)cc1
InChIInChI=1S/C18H24N4O2/c1-14(22-12-9-19-13-22)18(23)20-15-7-10-21(11-8-15)16-3-5-17(24-2)6-4-16/h3-6,9,12-15H,7-8,10-11H2,1-2H3,(H,20,23)/t14-/m1/s1
InChIKeyXENDGCBVEILHER-CQSZACIVSA-N
XLogP2.24
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

(2S)-N-cyclopentyl-2-[4-(4-methoxyphenyl)piperazin-1-yl]propanamide
CID 2576020
N-cyclohexyl-2-imidazol-1-ylpropanamide
CID 46458376
(2S)-2-imidazol-1-yl-N-[[1-(4-methoxyphenyl)cyclopentyl]methyl]propanamide
CID 126431688
1-(4-methoxyphenyl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]piperidin-4-amine
CID 56705944
N-[1-(4-methoxyphenyl)pyrrolidin-3-yl]prop-2-enamide
CID 139018722
(2R)-N-cycloheptyl-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propanamide
CID 9461962
N-(cyclopentylcarbamoyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]propanamide
CID 18093958
2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(4-methylphenyl)propanamide
CID 18078494
(3S)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide
CID 95326859
(2S)-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-imidazol-1-ylpropanamide
CID 51583896
2-hydroxy-2-(4-methoxyphenyl)-N-[1-(3-methylphenyl)piperidin-4-yl]acetamide
CID 118763996
(2R)-N-(cyclopentylcarbamoyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propanamide
CID 9462162

Frequently Asked Questions

What is the IUPAC name of (2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide?
The IUPAC name of (2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide (CID 95291018) is (2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide.
What is the SMILES notation for (2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide?
The canonical SMILES for (2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide is COc1ccc(N2CCC(NC(=O)[C@@H](C)n3ccnc3)CC2)cc1.
What is the InChIKey of (2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide?
The InChIKey is XENDGCBVEILHER-CQSZACIVSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-14(22-12-9-19-13-22)18(23)20-15-7-10-21(11-8-15)16-3-5-17(24-2)6-4-16/h3-6,9,12-15H,7-8,10-11H2,1-2H3,(H,20,23)/t14-/m1/s1.
What are the key properties of (2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide?
(2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide has a molecular weight of 328.42 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-imidazol-1-yl-N-[1-(4-methoxyphenyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 95291018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).