2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile

C14H14N4 — CID 156819085

IUPAC2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile
SMILESN#Cc1cc2nc(N3CCCCC3)ccc2cn1
InChIInChI=1S/C14H14N4/c15-9-12-8-13-11(10-16-12)4-5-14(17-13)18-6-2-1-3-7-18/h4-5,8,10H,1-3,6-7H2
InChIKeyMCCFMSQJONSMCR-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.49
Rot. Bonds1

About 2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile

2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile (PubChem CID 156819085) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile.

Molecular Properties

Compound Name2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile
PubChem CID156819085
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile
SMILESN#Cc1cc2nc(N3CCCCC3)ccc2cn1
InChIInChI=1S/C14H14N4/c15-9-12-8-13-11(10-16-12)4-5-14(17-13)18-6-2-1-3-7-18/h4-5,8,10H,1-3,6-7H2
InChIKeyMCCFMSQJONSMCR-UHFFFAOYSA-N
XLogP2.49
TPSA52.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile?
The IUPAC name of 2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile (CID 156819085) is 2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile.
What is the SMILES notation for 2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile?
The canonical SMILES for 2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile is N#Cc1cc2nc(N3CCCCC3)ccc2cn1.
What is the InChIKey of 2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile?
The InChIKey is MCCFMSQJONSMCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c15-9-12-8-13-11(10-16-12)4-5-14(17-13)18-6-2-1-3-7-18/h4-5,8,10H,1-3,6-7H2.
What are the key properties of 2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile?
2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile has a molecular weight of 238.29 g/mol, XLogP of 2.49, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-1-yl-1,6-naphthyridine-7-carbonitrile is sourced from PubChem (CID 156819085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).