N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide

C23H29N3O2 — CID 135259516

IUPACN-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide
SMILESCOc1cccc(-c2ccc(N(C(=O)CN3CCN(C)CC3)C3CC3)cc2)c1
InChIInChI=1S/C23H29N3O2/c1-24-12-14-25(15-13-24)17-23(27)26(21-10-11-21)20-8-6-18(7-9-20)19-4-3-5-22(16-19)28-2/h3-9,16,21H,10-15,17H2,1-2H3
InChIKeyJECALMIGEBGTRQ-UHFFFAOYSA-N
MW379.50 g/mol
LogP3.11
Rot. Bonds6

About N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide

N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide (PubChem CID 135259516) has the molecular formula C23H29N3O2 and a molecular weight of 379.50 g/mol. Its IUPAC name is N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide
PubChem CID135259516
Molecular FormulaC23H29N3O2
Molecular Weight379.50 g/mol
Exact Mass379.23
IUPAC NameN-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide
SMILESCOc1cccc(-c2ccc(N(C(=O)CN3CCN(C)CC3)C3CC3)cc2)c1
InChIInChI=1S/C23H29N3O2/c1-24-12-14-25(15-13-24)17-23(27)26(21-10-11-21)20-8-6-18(7-9-20)19-4-3-5-22(16-19)28-2/h3-9,16,21H,10-15,17H2,1-2H3
InChIKeyJECALMIGEBGTRQ-UHFFFAOYSA-N
XLogP3.11
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.50
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-(4-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)ethanone
CID 170862095
N-(3-methoxyphenyl)-2-(4-methylpiperazin-1-yl)acetamide;hydrochloride
CID 2958479
N-(4-methoxyphenyl)-N-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-3-methylbutanamide
CID 42853287
2-(5-hydroxy-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-1-[4-(3-methoxyphenyl)phenyl]ethanone
CID 144818994
4-[2-[bis[(3-methoxyphenyl)methyl]amino]-2-oxoethyl]piperazine-1-carboxylic acid
CID 175572183
N-(1-benzylpiperidin-4-yl)-N-(3-methoxyphenyl)-3-methylbutanamide
CID 46047800
3-[3-(3-methoxyphenyl)phenyl]-1-methyl-1-[(3R)-1-methylpyrrolidin-3-yl]urea
CID 97277934
4-(3-methoxyphenyl)-N,N-diphenylaniline
CID 175141155
N-(3-methoxyphenyl)-2-methyl-N-[1-[(4-nitrophenyl)methyl]piperidin-4-yl]propanamide
CID 42856599
1-(3-methoxyphenyl)-4-[(1-methylpiperidin-4-yl)methyl]piperazine
CID 171069764
1-[3-(4-methylphenyl)phenyl]-2-(4-methylpiperazin-1-yl)ethanone
CID 170862084
4-methoxy-N-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-phenylbenzamide
CID 46047925

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide?
The IUPAC name of N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide (CID 135259516) is N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide?
The canonical SMILES for N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide is COc1cccc(-c2ccc(N(C(=O)CN3CCN(C)CC3)C3CC3)cc2)c1.
What is the InChIKey of N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide?
The InChIKey is JECALMIGEBGTRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O2/c1-24-12-14-25(15-13-24)17-23(27)26(21-10-11-21)20-8-6-18(7-9-20)19-4-3-5-22(16-19)28-2/h3-9,16,21H,10-15,17H2,1-2H3.
What are the key properties of N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide?
N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide has a molecular weight of 379.50 g/mol, XLogP of 3.11, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[4-(3-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide is sourced from PubChem (CID 135259516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).