N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide

C23H29N3O — CID 9119487

IUPACN-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide
SMILESCN1CCN(c2ccccc2NC(=O)C2(c3ccccc3)CCCC2)CC1
InChIInChI=1S/C23H29N3O/c1-25-15-17-26(18-16-25)21-12-6-5-11-20(21)24-22(27)23(13-7-8-14-23)19-9-3-2-4-10-19/h2-6,9-12H,7-8,13-18H2,1H3,(H,24,27)
InChIKeyFKOWYHLXAYBTAY-UHFFFAOYSA-N
MW363.51 g/mol
LogP3.89
Rot. Bonds4

About N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide

N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide (PubChem CID 9119487) has the molecular formula C23H29N3O and a molecular weight of 363.51 g/mol. Its IUPAC name is N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide
PubChem CID9119487
Molecular FormulaC23H29N3O
Molecular Weight363.51 g/mol
Exact Mass363.23
IUPAC NameN-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide
SMILESCN1CCN(c2ccccc2NC(=O)C2(c3ccccc3)CCCC2)CC1
InChIInChI=1S/C23H29N3O/c1-25-15-17-26(18-16-25)21-12-6-5-11-20(21)24-22(27)23(13-7-8-14-23)19-9-3-2-4-10-19/h2-6,9-12H,7-8,13-18H2,1H3,(H,24,27)
InChIKeyFKOWYHLXAYBTAY-UHFFFAOYSA-N
XLogP3.89
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.51
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1-hydroxycyclopentyl)methyl]-3-[2-(4-methylpiperazin-1-yl)phenyl]urea
CID 110907910
1-[2-(4-methylpiperazin-1-yl)phenyl]-3-phenylurea
CID 41430695
2-[(1-phenylcyclopentanecarbonyl)amino]benzamide
CID 28624302
N-(2-nitrophenyl)-1-phenylcyclopentane-1-carboxamide
CID 2877363
[2-(4-methylpiperazin-1-yl)phenyl]thiourea
CID 4275618
N-naphthalen-1-yl-1-phenylcyclobutane-1-carboxamide
CID 32618502
1-amino-N-(2-pyrrolidin-1-ylphenyl)cyclobutane-1-carboxamide
CID 81179461
3-methyl-N-(2-piperidin-1-ylphenyl)pyrrolidine-3-carboxamide
CID 63141494
N-[2-(4-methylpiperazin-1-yl)phenyl]-2-(4-phenoxyphenoxy)acetamide
CID 43039942
N-(2-piperidin-1-ylphenyl)propanamide
CID 960826
N-[2-(4-methylpiperazin-1-yl)phenyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
CID 18189834
3-(benzenesulfonamido)-N-[2-(4-methylpiperazin-1-yl)phenyl]propanamide
CID 55359461

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide?
The IUPAC name of N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide (CID 9119487) is N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide?
The canonical SMILES for N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide is CN1CCN(c2ccccc2NC(=O)C2(c3ccccc3)CCCC2)CC1.
What is the InChIKey of N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide?
The InChIKey is FKOWYHLXAYBTAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O/c1-25-15-17-26(18-16-25)21-12-6-5-11-20(21)24-22(27)23(13-7-8-14-23)19-9-3-2-4-10-19/h2-6,9-12H,7-8,13-18H2,1H3,(H,24,27).
What are the key properties of N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide?
N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide has a molecular weight of 363.51 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylpiperazin-1-yl)phenyl]-1-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 9119487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).