N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide

C20H25N3O2 — CID 146132326

IUPACN-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide
SMILESCc1cc(=O)[nH]c2cc(C(=O)NC3CCN(CC4CC4)CC3)ccc12
InChIInChI=1S/C20H25N3O2/c1-13-10-19(24)22-18-11-15(4-5-17(13)18)20(25)21-16-6-8-23(9-7-16)12-14-2-3-14/h4-5,10-11,14,16H,2-3,6-9,12H2,1H3,(H,21,25)(H,22,24)
InChIKeyJHJLTAUVUSJSLU-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.44
Rot. Bonds4

About N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide

N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide (PubChem CID 146132326) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide.

Molecular Properties

Compound NameN-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide
PubChem CID146132326
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC NameN-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide
SMILESCc1cc(=O)[nH]c2cc(C(=O)NC3CCN(CC4CC4)CC3)ccc12
InChIInChI=1S/C20H25N3O2/c1-13-10-19(24)22-18-11-15(4-5-17(13)18)20(25)21-16-6-8-23(9-7-16)12-14-2-3-14/h4-5,10-11,14,16H,2-3,6-9,12H2,1H3,(H,21,25)(H,22,24)
InChIKeyJHJLTAUVUSJSLU-UHFFFAOYSA-N
XLogP2.44
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-ethylpiperidin-4-yl)-3,4-dimethylbenzamide
CID 17249701
N-cyclopropyl-1'-(cyclopropylmethyl)-2-oxospiro[1H-indole-3,4'-piperidine]-5-carboxamide
CID 124554168
4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide
CID 54915908
4-amino-N-cyclohexyl-3-methoxybenzamide;1-(cyclopropylmethyl)piperazine;ethane
CID 143522216
4-hydroxy-3-methyl-N-(1-propylpiperidin-4-yl)benzamide
CID 103951674
N-cyclohexyl-3-[(4-ethoxy-3-methylphenyl)methyl]-2,4-dioxo-1H-quinazoline-7-carboxamide
CID 130460812
4-nitro-N-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]cyclohexyl]benzamide
CID 67741876
N-[1-(cyclopropylmethyl)piperidin-4-yl]-2-hydroxy-2-phenylacetamide
CID 139005711
N-cyclopropyl-3-[6-[(3R)-1-(cyclopropylmethyl)pyrrolidin-3-yl]oxy-4-oxoquinazolin-3-yl]-4-methylbenzamide
CID 66918975
N-cyclopropyl-3-[6-[(3S)-1-(cyclopropylmethyl)pyrrolidin-3-yl]oxy-4-oxoquinazolin-3-yl]-4-methylbenzamide
CID 66918995
3-methyl-N-(1-propylpiperidin-4-yl)benzamide
CID 17249825
3-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]benzamide
CID 71784695

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide?
The IUPAC name of N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide (CID 146132326) is N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide.
What is the SMILES notation for N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide?
The canonical SMILES for N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide is Cc1cc(=O)[nH]c2cc(C(=O)NC3CCN(CC4CC4)CC3)ccc12.
What is the InChIKey of N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide?
The InChIKey is JHJLTAUVUSJSLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-13-10-19(24)22-18-11-15(4-5-17(13)18)20(25)21-16-6-8-23(9-7-16)12-14-2-3-14/h4-5,10-11,14,16H,2-3,6-9,12H2,1H3,(H,21,25)(H,22,24).
What are the key properties of N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide?
N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 2.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopropylmethyl)piperidin-4-yl]-4-methyl-2-oxo-1H-quinoline-7-carboxamide is sourced from PubChem (CID 146132326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).