2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine

C14H22N2 — CID 165372704

IUPAC2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine
SMILESCC(C)C1Cc2cnccc2CN1C(C)C
InChIInChI=1S/C14H22N2/c1-10(2)14-7-13-8-15-6-5-12(13)9-16(14)11(3)4/h5-6,8,10-11,14H,7,9H2,1-4H3
InChIKeyKMWNZPQWXCLKLK-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.87
Rot. Bonds2

About 2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine

2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine (PubChem CID 165372704) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine.

Molecular Properties

Compound Name2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine
PubChem CID165372704
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine
SMILESCC(C)C1Cc2cnccc2CN1C(C)C
InChIInChI=1S/C14H22N2/c1-10(2)14-7-13-8-15-6-5-12(13)9-16(14)11(3)4/h5-6,8,10-11,14H,7,9H2,1-4H3
InChIKeyKMWNZPQWXCLKLK-UHFFFAOYSA-N
XLogP2.87
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine?
The IUPAC name of 2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine (CID 165372704) is 2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine.
What is the SMILES notation for 2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine?
The canonical SMILES for 2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine is CC(C)C1Cc2cnccc2CN1C(C)C.
What is the InChIKey of 2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine?
The InChIKey is KMWNZPQWXCLKLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-10(2)14-7-13-8-15-6-5-12(13)9-16(14)11(3)4/h5-6,8,10-11,14H,7,9H2,1-4H3.
What are the key properties of 2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine?
2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine has a molecular weight of 218.34 g/mol, XLogP of 2.87, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine is sourced from PubChem (CID 165372704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).