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

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).