N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide

C18H26N2O3 — CID 50952378

IUPACN-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide
SMILESCCCCC(=O)Nc1ccc(C(=O)NC2(CO)CCCC2)cc1
InChIInChI=1S/C18H26N2O3/c1-2-3-6-16(22)19-15-9-7-14(8-10-15)17(23)20-18(13-21)11-4-5-12-18/h7-10,21H,2-6,11-13H2,1H3,(H,19,22)(H,20,23)
InChIKeyCMZSSSDRSJFUIX-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.85
Rot. Bonds7

About N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide

N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide (PubChem CID 50952378) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide
PubChem CID50952378
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC NameN-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide
SMILESCCCCC(=O)Nc1ccc(C(=O)NC2(CO)CCCC2)cc1
InChIInChI=1S/C18H26N2O3/c1-2-3-6-16(22)19-15-9-7-14(8-10-15)17(23)20-18(13-21)11-4-5-12-18/h7-10,21H,2-6,11-13H2,1H3,(H,19,22)(H,20,23)
InChIKeyCMZSSSDRSJFUIX-UHFFFAOYSA-N
XLogP2.85
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide 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

N-[4-[[[6-oxo-6-[2-[4-(pentanoylamino)benzoyl]hydrazinyl]hexanoyl]amino]carbamoyl]phenyl]pentanamide
CID 4926555
N-(4-methylphenyl)-4-(pentanoylamino)benzamide
CID 4630697
N-[4-[(hexanoylamino)carbamoyl]phenyl]pentanamide
CID 4953980
N-[1-(hydroxymethyl)cyclopentyl]heptanamide
CID 62518617
4-ethylsulfanyl-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 110008816
4-(dodecanoylamino)-N-phenylbenzamide
CID 5109500
N-[4-[(octanoylamino)carbamoyl]phenyl]pentanamide
CID 4958829
1-[4-(pentanoylamino)phenyl]cyclopropane-1-carboxylic acid
CID 112557929
1-N-[1-(hydroxymethyl)cyclopentyl]-4-N,4-N-dimethylbenzene-1,4-dicarboxamide
CID 110008768
N,N'-bis[4-(butylcarbamoyl)phenyl]pentanediamide
CID 17195941
N,N'-bis[4-(butylcarbamoyl)phenyl]hexanediamide
CID 17195940
N-[1-(hydroxymethyl)cyclopropyl]pentanamide
CID 115764875

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide (CID 50952378) is N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide is CCCCC(=O)Nc1ccc(C(=O)NC2(CO)CCCC2)cc1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide?
The InChIKey is CMZSSSDRSJFUIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-2-3-6-16(22)19-15-9-7-14(8-10-15)17(23)20-18(13-21)11-4-5-12-18/h7-10,21H,2-6,11-13H2,1H3,(H,19,22)(H,20,23).
What are the key properties of N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide?
N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide has a molecular weight of 318.42 g/mol, XLogP of 2.85, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclopentyl]-4-(pentanoylamino)benzamide is sourced from PubChem (CID 50952378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).