6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine

C13H20N2 — CID 134424563

IUPAC6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine
SMILESC=C(C)N1CCCC2=C1C=NC(CC)C2
InChIInChI=1S/C13H20N2/c1-4-12-8-11-6-5-7-15(10(2)3)13(11)9-14-12/h9,12H,2,4-8H2,1,3H3
InChIKeyZMSNJNOECUCLTC-UHFFFAOYSA-N
MW204.32 g/mol
LogP3.12
Rot. Bonds2

About 6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine

6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine (PubChem CID 134424563) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine.

Molecular Properties

Compound Name6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine
PubChem CID134424563
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine
SMILESC=C(C)N1CCCC2=C1C=NC(CC)C2
InChIInChI=1S/C13H20N2/c1-4-12-8-11-6-5-7-15(10(2)3)13(11)9-14-12/h9,12H,2,4-8H2,1,3H3
InChIKeyZMSNJNOECUCLTC-UHFFFAOYSA-N
XLogP3.12
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine?
The IUPAC name of 6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine (CID 134424563) is 6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine.
What is the SMILES notation for 6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine?
The canonical SMILES for 6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine is C=C(C)N1CCCC2=C1C=NC(CC)C2.
What is the InChIKey of 6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine?
The InChIKey is ZMSNJNOECUCLTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-4-12-8-11-6-5-7-15(10(2)3)13(11)9-14-12/h9,12H,2,4-8H2,1,3H3.
What are the key properties of 6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine?
6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine has a molecular weight of 204.32 g/mol, XLogP of 3.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine is sourced from PubChem (CID 134424563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).