3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide

C17H24N2O2 — CID 27604546

IUPAC3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide
SMILESCCC(=O)N1CCCc2ccc(NC(=O)CC(C)C)cc21
InChIInChI=1S/C17H24N2O2/c1-4-17(21)19-9-5-6-13-7-8-14(11-15(13)19)18-16(20)10-12(2)3/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,18,20)
InChIKeyQVSBRUCPNKLPPR-UHFFFAOYSA-N
MW288.39 g/mol
LogP3.36
Rot. Bonds4

About 3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide

3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide (PubChem CID 27604546) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide.

Molecular Properties

Compound Name3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide
PubChem CID27604546
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide
SMILESCCC(=O)N1CCCc2ccc(NC(=O)CC(C)C)cc21
InChIInChI=1S/C17H24N2O2/c1-4-17(21)19-9-5-6-13-7-8-14(11-15(13)19)18-16(20)10-12(2)3/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,18,20)
InChIKeyQVSBRUCPNKLPPR-UHFFFAOYSA-N
XLogP3.36
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)cyclopropanecarboxamide
CID 40829046
N-[1-(furan-2-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-3-methylbutanamide
CID 7517311
2-(3,4-dimethoxyphenyl)-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)acetamide
CID 16835104
N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-6-yl]-3-methylbutanamide
CID 7656487
3-(4-methoxyphenyl)-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)propanamide
CID 27604553
2-methoxy-N-[1-(2-methoxyacetyl)-3,4-dihydro-2H-quinolin-7-yl]acetamide
CID 16835177
N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)naphthalene-1-carboxamide
CID 16835101
1-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)-3-thiophen-2-ylurea
CID 30372226
1-(7-amino-3,4-dihydro-2H-quinolin-1-yl)propan-1-one
CID 28707153
3,4,5-triethoxy-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)benzamide
CID 27604624
1-[7-(1-hydroxypropyl)-3,4-dihydro-2H-quinolin-1-yl]propan-1-one
CID 82263716
2-[(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)hydrazinylidene]propanedinitrile
CID 169337813

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide?
The IUPAC name of 3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide (CID 27604546) is 3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide.
What is the SMILES notation for 3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide?
The canonical SMILES for 3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide is CCC(=O)N1CCCc2ccc(NC(=O)CC(C)C)cc21.
What is the InChIKey of 3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide?
The InChIKey is QVSBRUCPNKLPPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-4-17(21)19-9-5-6-13-7-8-14(11-15(13)19)18-16(20)10-12(2)3/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,18,20).
What are the key properties of 3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide?
3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide has a molecular weight of 288.39 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide is sourced from PubChem (CID 27604546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).