N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide

C18H24N2O3 — CID 110298878

IUPACN-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide
SMILESCCCCN(C)C(=O)CCc1cc2ccc(OC)cc2[nH]c1=O
InChIInChI=1S/C18H24N2O3/c1-4-5-10-20(2)17(21)9-7-14-11-13-6-8-15(23-3)12-16(13)19-18(14)22/h6,8,11-12H,4-5,7,9-10H2,1-3H3,(H,19,22)
InChIKeyVBJJDHLATJNJBA-UHFFFAOYSA-N
MW316.40 g/mol
LogP2.73
Rot. Bonds7

About N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide

N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide (PubChem CID 110298878) has the molecular formula C18H24N2O3 and a molecular weight of 316.40 g/mol. Its IUPAC name is N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide.

Molecular Properties

Compound NameN-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide
PubChem CID110298878
Molecular FormulaC18H24N2O3
Molecular Weight316.40 g/mol
Exact Mass316.18
IUPAC NameN-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide
SMILESCCCCN(C)C(=O)CCc1cc2ccc(OC)cc2[nH]c1=O
InChIInChI=1S/C18H24N2O3/c1-4-5-10-20(2)17(21)9-7-14-11-13-6-8-15(23-3)12-16(13)19-18(14)22/h6,8,11-12H,4-5,7,9-10H2,1-3H3,(H,19,22)
InChIKeyVBJJDHLATJNJBA-UHFFFAOYSA-N
XLogP2.73
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-pentylpropanamide
CID 110298877
N-butyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-(4-methoxyphenyl)acetamide
CID 3932848
N,N-diethyl-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)propanamide
CID 53174783
ethyl 4-[3-(7-methoxy-2-oxo-1H-quinolin-3-yl)propanoyl]piperazine-1-carboxylate
CID 110298870
N-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-2-propylpentanamide
CID 4079737
3-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1,1-dimethylurea
CID 110324804
N-(4-chlorophenyl)-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)propanamide
CID 110298893
3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)propanamide
CID 110298967
2-ethoxy-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylbenzamide
CID 3442794
N-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-2-(4-methoxyphenyl)acetamide
CID 4258688
2-chloro-N-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]acetamide
CID 7136774
N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide
CID 110426059

Frequently Asked Questions

What is the IUPAC name of N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide?
The IUPAC name of N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide (CID 110298878) is N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide.
What is the SMILES notation for N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide?
The canonical SMILES for N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide is CCCCN(C)C(=O)CCc1cc2ccc(OC)cc2[nH]c1=O.
What is the InChIKey of N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide?
The InChIKey is VBJJDHLATJNJBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3/c1-4-5-10-20(2)17(21)9-7-14-11-13-6-8-15(23-3)12-16(13)19-18(14)22/h6,8,11-12H,4-5,7,9-10H2,1-3H3,(H,19,22).
What are the key properties of N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide?
N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide has a molecular weight of 316.40 g/mol, XLogP of 2.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide is sourced from PubChem (CID 110298878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).