N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide

C20H27N3O — CID 118788154

IUPACN-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide
SMILESCc1ccc(CNC(=O)CCC(C)N2CCCC2)c2cccnc12
InChIInChI=1S/C20H27N3O/c1-15-7-9-17(18-6-5-11-21-20(15)18)14-22-19(24)10-8-16(2)23-12-3-4-13-23/h5-7,9,11,16H,3-4,8,10,12-14H2,1-2H3,(H,22,24)
InChIKeyJHVYDFSGLDZBNU-UHFFFAOYSA-N
MW325.46 g/mol
LogP3.42
Rot. Bonds6

About N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide

N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide (PubChem CID 118788154) has the molecular formula C20H27N3O and a molecular weight of 325.46 g/mol. Its IUPAC name is N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide.

Molecular Properties

Compound NameN-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide
PubChem CID118788154
Molecular FormulaC20H27N3O
Molecular Weight325.46 g/mol
Exact Mass325.22
IUPAC NameN-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide
SMILESCc1ccc(CNC(=O)CCC(C)N2CCCC2)c2cccnc12
InChIInChI=1S/C20H27N3O/c1-15-7-9-17(18-6-5-11-21-20(15)18)14-22-19(24)10-8-16(2)23-12-3-4-13-23/h5-7,9,11,16H,3-4,8,10,12-14H2,1-2H3,(H,22,24)
InChIKeyJHVYDFSGLDZBNU-UHFFFAOYSA-N
XLogP3.42
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide 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-[(8-methylquinolin-5-yl)methyl]pyridazine-4-carboxamide
CID 90652525
(4R)-N-[(5-methyl-1H-imidazol-4-yl)methyl]-4-pyrrolidin-1-ylpentanamide
CID 126435440
1-[(4-methylnaphthalen-1-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)methyl]urea
CID 167827928
N-[(4-fluoro-2-methoxyphenyl)methyl]-4-pyrrolidin-1-ylpentanamide;formic acid
CID 154905412
2-methyl-N-[2-[(8-methylquinolin-5-yl)carbamoylamino]ethyl]propanamide
CID 47033502
3-(propan-2-ylamino)-N-(quinolin-8-ylmethyl)propanamide
CID 81427173
2-(2-pyrrolidin-1-ylpropoxy)-N-(2-quinolin-8-ylethyl)acetamide
CID 126819530
N-[[(3R)-1-[(8-methylquinolin-5-yl)methyl]piperidin-3-yl]methyl]methanesulfonamide
CID 95218558
(4R)-4-pyrrolidin-1-yl-N-[3-(1,3-thiazol-2-yl)propyl]pentanamide
CID 126452069
(4R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-4-pyrrolidin-1-ylpentanamide
CID 126435454
N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]-4-pyrrolidin-1-ylpentanamide
CID 136607695
1-(8-methylquinolin-5-yl)-3-(3-pyrrolidin-1-ylpropyl)urea
CID 72861388

Frequently Asked Questions

What is the IUPAC name of N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide?
The IUPAC name of N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide (CID 118788154) is N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide.
What is the SMILES notation for N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide?
The canonical SMILES for N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide is Cc1ccc(CNC(=O)CCC(C)N2CCCC2)c2cccnc12.
What is the InChIKey of N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide?
The InChIKey is JHVYDFSGLDZBNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O/c1-15-7-9-17(18-6-5-11-21-20(15)18)14-22-19(24)10-8-16(2)23-12-3-4-13-23/h5-7,9,11,16H,3-4,8,10,12-14H2,1-2H3,(H,22,24).
What are the key properties of N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide?
N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide has a molecular weight of 325.46 g/mol, XLogP of 3.42, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(8-methylquinolin-5-yl)methyl]-4-pyrrolidin-1-ylpentanamide is sourced from PubChem (CID 118788154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).