N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide

C20H23N3O2 — CID 127254662

IUPACN-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide
SMILESCc1cc(=O)[nH]c2cc(NC(=O)CCCCCn3cccc3)ccc12
InChIInChI=1S/C20H23N3O2/c1-15-13-20(25)22-18-14-16(8-9-17(15)18)21-19(24)7-3-2-4-10-23-11-5-6-12-23/h5-6,8-9,11-14H,2-4,7,10H2,1H3,(H,21,24)(H,22,25)
InChIKeyRNJAPTYOANSULL-UHFFFAOYSA-N
MW337.42 g/mol
LogP3.84
Rot. Bonds7

About N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide

N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide (PubChem CID 127254662) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide.

Molecular Properties

Compound NameN-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide
PubChem CID127254662
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide
SMILESCc1cc(=O)[nH]c2cc(NC(=O)CCCCCn3cccc3)ccc12
InChIInChI=1S/C20H23N3O2/c1-15-13-20(25)22-18-14-16(8-9-17(15)18)21-19(24)7-3-2-4-10-23-11-5-6-12-23/h5-6,8-9,11-14H,2-4,7,10H2,1H3,(H,21,24)(H,22,25)
InChIKeyRNJAPTYOANSULL-UHFFFAOYSA-N
XLogP3.84
TPSA66.89 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide 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-(2-methyl-3H-benzimidazol-5-yl)-6-pyrrol-1-ylhexanamide
CID 127255298
N-[2-(hydroxymethyl)-3H-benzimidazol-5-yl]-6-pyrrol-1-ylhexanamide
CID 127254570
(2S)-4-methyl-N-(4-methyl-2-oxo-1H-quinolin-7-yl)-2-pyrrol-1-ylpentanamide
CID 126418132
N-(4-methyl-2-oxo-1H-quinolin-7-yl)-4-methylsulfanyl-2-pyrrol-1-ylbutanamide
CID 121238974
N-(4-methyl-2-oxo-1H-quinolin-7-yl)-2-(1,4,7,10-tetrazacyclododec-1-yl)acetamide
CID 10715191
2-[bis[2-[carboxymethyl-[2-[(4-methyl-2-oxo-1H-quinolin-7-yl)amino]-2-oxoethyl]amino]ethyl]amino]acetic acid
CID 101390689
N-[3-(dimethylamino)-4-methylphenyl]-3-pyrrol-1-ylpropanamide
CID 46343165
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-pyrrol-1-ylhexanamide
CID 127254983
N-(3-acetamidophenyl)-3-pyrrol-1-ylpropanamide
CID 110688727
N-(3,4-difluorophenyl)-3-pyrrol-1-ylpropanamide
CID 110688754
N-[4-methoxy-3-(2H-tetrazol-5-yl)phenyl]-6-pyrrol-1-ylhexanamide
CID 127254540
N-(4-methyl-2-oxochromen-7-yl)-3-(2-oxo-1-pyridinyl)propanamide
CID 172659008

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide?
The IUPAC name of N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide (CID 127254662) is N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide.
What is the SMILES notation for N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide?
The canonical SMILES for N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide is Cc1cc(=O)[nH]c2cc(NC(=O)CCCCCn3cccc3)ccc12.
What is the InChIKey of N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide?
The InChIKey is RNJAPTYOANSULL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-15-13-20(25)22-18-14-16(8-9-17(15)18)21-19(24)7-3-2-4-10-23-11-5-6-12-23/h5-6,8-9,11-14H,2-4,7,10H2,1H3,(H,21,24)(H,22,25).
What are the key properties of N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide?
N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide has a molecular weight of 337.42 g/mol, XLogP of 3.84, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-oxo-1H-quinolin-7-yl)-6-pyrrol-1-ylhexanamide is sourced from PubChem (CID 127254662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).