1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide

C15H17N3O2 — CID 78897275

IUPAC1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide
SMILESCc1cc(CN2CCCc3c(C(N)=O)cccc32)no1
InChIInChI=1S/C15H17N3O2/c1-10-8-11(17-20-10)9-18-7-3-5-12-13(15(16)19)4-2-6-14(12)18/h2,4,6,8H,3,5,7,9H2,1H3,(H2,16,19)
InChIKeyGAGURFYVDUQTIB-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.03
Rot. Bonds3

About 1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide

1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide (PubChem CID 78897275) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide.

Molecular Properties

Compound Name1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide
PubChem CID78897275
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide
SMILESCc1cc(CN2CCCc3c(C(N)=O)cccc32)no1
InChIInChI=1S/C15H17N3O2/c1-10-8-11(17-20-10)9-18-7-3-5-12-13(15(16)19)4-2-6-14(12)18/h2,4,6,8H,3,5,7,9H2,1H3,(H2,16,19)
InChIKeyGAGURFYVDUQTIB-UHFFFAOYSA-N
XLogP2.03
TPSA72.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide with MolForge

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Related Compounds

1-[(1-phenylpyrazol-4-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide
CID 167848457
1-(5-hydroxypentyl)-3,4-dihydro-2H-quinoline-5-carboxamide
CID 111495995
1-(pyridin-2-ylmethyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid
CID 60838604
1-(5,6-dihydro-4H-pyrrolo[2,1-e]pyrazol-2-ylmethyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid
CID 138003201
1-(3-methylbutanoyl)-3,4-dihydro-2H-quinoline-5-carboxamide
CID 86998468
1-[(3-methylpyrazin-2-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid
CID 167806762
1-(2,4-dimethylbenzoyl)-3,4-dihydro-2H-quinoline-5-carboxamide
CID 86982066
1-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid
CID 154740793
methyl 1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxylate
CID 47056603
1-[2-(benzylamino)-2-oxoethyl]-3,4-dihydro-2H-quinoline-5-carboxamide
CID 78866067
4-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1,4-benzoxazine
CID 75511652
N-[1-[[5-(aminomethyl)-1,2,4-oxadiazol-3-yl]methyl]-3,4-dihydro-2H-quinolin-5-yl]acetamide
CID 120751341

Frequently Asked Questions

What is the IUPAC name of 1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide?
The IUPAC name of 1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide (CID 78897275) is 1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide.
What is the SMILES notation for 1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide?
The canonical SMILES for 1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide is Cc1cc(CN2CCCc3c(C(N)=O)cccc32)no1.
What is the InChIKey of 1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide?
The InChIKey is GAGURFYVDUQTIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-8-11(17-20-10)9-18-7-3-5-12-13(15(16)19)4-2-6-14(12)18/h2,4,6,8H,3,5,7,9H2,1H3,(H2,16,19).
What are the key properties of 1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide?
1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,4-dihydro-2H-quinoline-5-carboxamide is sourced from PubChem (CID 78897275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).