2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide

C19H25N3O2 — CID 47028501

IUPAC2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide
SMILESCc1occc1C(=O)NCCN1CCN(C)CC1c1ccccc1
InChIInChI=1S/C19H25N3O2/c1-15-17(8-13-24-15)19(23)20-9-10-22-12-11-21(2)14-18(22)16-6-4-3-5-7-16/h3-8,13,18H,9-12,14H2,1-2H3,(H,20,23)
InChIKeyAHXZHRIXSYMQJG-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.31
Rot. Bonds5

About 2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide

2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide (PubChem CID 47028501) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide
PubChem CID47028501
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide
SMILESCc1occc1C(=O)NCCN1CCN(C)CC1c1ccccc1
InChIInChI=1S/C19H25N3O2/c1-15-17(8-13-24-15)19(23)20-9-10-22-12-11-21(2)14-18(22)16-6-4-3-5-7-16/h3-8,13,18H,9-12,14H2,1-2H3,(H,20,23)
InChIKeyAHXZHRIXSYMQJG-UHFFFAOYSA-N
XLogP2.31
TPSA48.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-acetyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]thiophene-2-carboxamide
CID 42958850
N-[2-[(2S)-4-methyl-2-phenylpiperazin-1-yl]ethyl]cyclobutanecarboxamide
CID 33403212
N-[3-(4-methyl-2-phenylpiperazin-1-yl)propyl]quinoline-4-carboxamide
CID 166205908
2-chloro-N-[3-(4-methyl-2-phenylpiperazin-1-yl)propyl]-5-methylsulfanylbenzamide
CID 42957275
2-methyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide
CID 30899733
methyl 4-(4-methyl-2-phenylpiperazin-1-yl)butanoate
CID 43377701
N-[3-[(2S)-4-methyl-2-phenylpiperazin-1-yl]propyl]-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 99844784
2-ethoxy-N-[3-(4-methyl-2-phenylpiperazin-1-yl)propyl]pyridine-3-carboxamide
CID 55620653
5-chloro-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-pyrrolidin-1-ylpyrimidine-4-carboxamide
CID 51964590
1-(3-chlorophenyl)-3-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]urea
CID 43063800
(2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide
CID 124810432
2-methyl-N-[[(3S)-1-phenylpyrrolidin-3-yl]methyl]furan-3-carboxamide
CID 38442503

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide?
The IUPAC name of 2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide (CID 47028501) is 2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide?
The canonical SMILES for 2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide is Cc1occc1C(=O)NCCN1CCN(C)CC1c1ccccc1.
What is the InChIKey of 2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide?
The InChIKey is AHXZHRIXSYMQJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-15-17(8-13-24-15)19(23)20-9-10-22-12-11-21(2)14-18(22)16-6-4-3-5-7-16/h3-8,13,18H,9-12,14H2,1-2H3,(H,20,23).
What are the key properties of 2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide?
2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide is sourced from PubChem (CID 47028501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).