3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide

C13H18N2O — CID 60698848

IUPAC3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide
SMILESCc1ccc2c(c1)CCCN2CCC(N)=O
InChIInChI=1S/C13H18N2O/c1-10-4-5-12-11(9-10)3-2-7-15(12)8-6-13(14)16/h4-5,9H,2-3,6-8H2,1H3,(H2,14,16)
InChIKeyAGQSDKXIPUSKAV-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.62
Rot. Bonds3

About 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide

3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide (PubChem CID 60698848) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide.

Molecular Properties

Compound Name3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide
PubChem CID60698848
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide
SMILESCc1ccc2c(c1)CCCN2CCC(N)=O
InChIInChI=1S/C13H18N2O/c1-10-4-5-12-11(9-10)3-2-7-15(12)8-6-13(14)16/h4-5,9H,2-3,6-8H2,1H3,(H2,14,16)
InChIKeyAGQSDKXIPUSKAV-UHFFFAOYSA-N
XLogP1.62
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)butanoic acid
CID 65249302
2-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-2-ol
CID 79317190
2-methyl-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanoic acid
CID 43538734
N-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-amine
CID 60840997
1-amino-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-ol
CID 24698210
ethane;1-ethyl-6-methyl-3,4-dihydro-2H-quinoline
CID 143643901
N'-hydroxy-2,2-dimethyl-5-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pentanimidamide
CID 77063046
N-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]propan-2-amine
CID 60841491
6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine
CID 106799282
2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]prop-2-en-1-amine
CID 103069126
2-[1-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclopropyl]acetic acid
CID 65498006
N-cyclopropyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)acetamide
CID 17383788

Frequently Asked Questions

What is the IUPAC name of 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide?
The IUPAC name of 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide (CID 60698848) is 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide.
What is the SMILES notation for 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide?
The canonical SMILES for 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide is Cc1ccc2c(c1)CCCN2CCC(N)=O.
What is the InChIKey of 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide?
The InChIKey is AGQSDKXIPUSKAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-10-4-5-12-11(9-10)3-2-7-15(12)8-6-13(14)16/h4-5,9H,2-3,6-8H2,1H3,(H2,14,16).
What are the key properties of 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide?
3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide has a molecular weight of 218.30 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide is sourced from PubChem (CID 60698848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).