2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine

C14H24N2 — CID 58748048

IUPAC2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine
SMILESCC(C)N1C=CC2=C(C1)CN(C(C)C)CC2
InChIInChI=1S/C14H24N2/c1-11(2)15-7-5-13-6-8-16(12(3)4)10-14(13)9-15/h5,7,11-12H,6,8-10H2,1-4H3
InChIKeyXYOCHWRPCKBBOR-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.63
Rot. Bonds2

About 2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine

2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine (PubChem CID 58748048) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine.

Molecular Properties

Compound Name2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine
PubChem CID58748048
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine
SMILESCC(C)N1C=CC2=C(C1)CN(C(C)C)CC2
InChIInChI=1S/C14H24N2/c1-11(2)15-7-5-13-6-8-16(12(3)4)10-14(13)9-15/h5,7,11-12H,6,8-10H2,1-4H3
InChIKeyXYOCHWRPCKBBOR-UHFFFAOYSA-N
XLogP2.63
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine?
The IUPAC name of 2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine (CID 58748048) is 2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine.
What is the SMILES notation for 2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine?
The canonical SMILES for 2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine is CC(C)N1C=CC2=C(C1)CN(C(C)C)CC2.
What is the InChIKey of 2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine?
The InChIKey is XYOCHWRPCKBBOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-11(2)15-7-5-13-6-8-16(12(3)4)10-14(13)9-15/h5,7,11-12H,6,8-10H2,1-4H3.
What are the key properties of 2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine?
2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine has a molecular weight of 220.36 g/mol, XLogP of 2.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-di(propan-2-yl)-1,3,4,8-tetrahydro-2,7-naphthyridine is sourced from PubChem (CID 58748048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).