1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide

C15H17ClN4O — CID 136568174

IUPAC1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(c2ccc3cc(Cl)cnc3n2)CC1
InChIInChI=1S/C15H17ClN4O/c1-17-15(21)10-4-6-20(7-5-10)13-3-2-11-8-12(16)9-18-14(11)19-13/h2-3,8-10H,4-7H2,1H3,(H,17,21)
InChIKeyTVLBDBCRRDEEJN-UHFFFAOYSA-N
MW304.78 g/mol
LogP2.25
Rot. Bonds2

About 1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide

1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide (PubChem CID 136568174) has the molecular formula C15H17ClN4O and a molecular weight of 304.78 g/mol. Its IUPAC name is 1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide
PubChem CID136568174
Molecular FormulaC15H17ClN4O
Molecular Weight304.78 g/mol
Exact Mass304.11
IUPAC Name1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(c2ccc3cc(Cl)cnc3n2)CC1
InChIInChI=1S/C15H17ClN4O/c1-17-15(21)10-4-6-20(7-5-10)13-3-2-11-8-12(16)9-18-14(11)19-13/h2-3,8-10H,4-7H2,1H3,(H,17,21)
InChIKeyTVLBDBCRRDEEJN-UHFFFAOYSA-N
XLogP2.25
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide?
The IUPAC name of 1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide (CID 136568174) is 1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide is CNC(=O)C1CCN(c2ccc3cc(Cl)cnc3n2)CC1.
What is the InChIKey of 1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide?
The InChIKey is TVLBDBCRRDEEJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN4O/c1-17-15(21)10-4-6-20(7-5-10)13-3-2-11-8-12(16)9-18-14(11)19-13/h2-3,8-10H,4-7H2,1H3,(H,17,21).
What are the key properties of 1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide?
1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide has a molecular weight of 304.78 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-chloro-1,8-naphthyridin-2-yl)-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 136568174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).