N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide

C20H27N3O2 — CID 154780356

IUPACN-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide
SMILESCC(C)C1CCCN(C(=O)NCc2cc3ccccc3n(C)c2=O)C1
InChIInChI=1S/C20H27N3O2/c1-14(2)16-8-6-10-23(13-16)20(25)21-12-17-11-15-7-4-5-9-18(15)22(3)19(17)24/h4-5,7,9,11,14,16H,6,8,10,12-13H2,1-3H3,(H,21,25)
InChIKeyUTYSGPXFJZACFN-UHFFFAOYSA-N
MW341.46 g/mol
LogP3.12
Rot. Bonds3

About N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide

N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide (PubChem CID 154780356) has the molecular formula C20H27N3O2 and a molecular weight of 341.46 g/mol. Its IUPAC name is N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide
PubChem CID154780356
Molecular FormulaC20H27N3O2
Molecular Weight341.46 g/mol
Exact Mass341.21
IUPAC NameN-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide
SMILESCC(C)C1CCCN(C(=O)NCc2cc3ccccc3n(C)c2=O)C1
InChIInChI=1S/C20H27N3O2/c1-14(2)16-8-6-10-23(13-16)20(25)21-12-17-11-15-7-4-5-9-18(15)22(3)19(17)24/h4-5,7,9,11,14,16H,6,8,10,12-13H2,1-3H3,(H,21,25)
InChIKeyUTYSGPXFJZACFN-UHFFFAOYSA-N
XLogP3.12
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-4-N-propan-2-ylbenzene-1,4-dicarboxamide
CID 154796285
N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-1-prop-2-enoylpyrrolidine-2-carboxamide
CID 166420208
4-[(1-methyl-2-oxoquinolin-3-yl)methylcarbamoylamino]cyclohexane-1-carboxylic acid
CID 122015078
N-[2-[(3R)-1-[(1-methyl-2-oxoquinolin-3-yl)methyl]piperidin-3-yl]ethyl]acetamide
CID 95210015
1-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyrazole-4-carboxamide
CID 138042455
N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-N-(1-propan-2-ylpyrrolidin-3-yl)cyclohexanecarboxamide
CID 75148825
(3S)-N-[(1-methylbenzimidazol-2-yl)methyl]-3-(methylsulfonylmethyl)piperidine-1-carboxamide
CID 125145269
1-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-(oxolan-3-yl)pyrazole-4-carboxamide
CID 167848659
(1-methylindol-2-yl)-[4-(propan-2-ylamino)piperidin-1-yl]methanone
CID 90380576
3-(1-hydroxyethyl)-N-[(6-methyl-2-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidine-1-carboxamide
CID 110028358
4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide
CID 136545220
N-[(1,6-dimethyl-2-oxo-3-pyridinyl)methyl]-3-(trifluoromethyl)piperidine-1-carboxamide
CID 132971346

Frequently Asked Questions

What is the IUPAC name of N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide?
The IUPAC name of N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide (CID 154780356) is N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide.
What is the SMILES notation for N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide?
The canonical SMILES for N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide is CC(C)C1CCCN(C(=O)NCc2cc3ccccc3n(C)c2=O)C1.
What is the InChIKey of N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide?
The InChIKey is UTYSGPXFJZACFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2/c1-14(2)16-8-6-10-23(13-16)20(25)21-12-17-11-15-7-4-5-9-18(15)22(3)19(17)24/h4-5,7,9,11,14,16H,6,8,10,12-13H2,1-3H3,(H,21,25).
What are the key properties of N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide?
N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide has a molecular weight of 341.46 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-3-propan-2-ylpiperidine-1-carboxamide is sourced from PubChem (CID 154780356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).