6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine

C12H16N2 — CID 3058702

IUPAC6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine
SMILESc1cnc2c(c1)CN(CC1CC1)CC2
InChIInChI=1S/C12H16N2/c1-2-11-9-14(8-10-3-4-10)7-5-12(11)13-6-1/h1-2,6,10H,3-5,7-9H2
InChIKeyBPIYGYNKZVZXOP-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.85
Rot. Bonds2

About 6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine

6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine (PubChem CID 3058702) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine.

Molecular Properties

Compound Name6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine
PubChem CID3058702
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine
SMILESc1cnc2c(c1)CN(CC1CC1)CC2
InChIInChI=1S/C12H16N2/c1-2-11-9-14(8-10-3-4-10)7-5-12(11)13-6-1/h1-2,6,10H,3-5,7-9H2
InChIKeyBPIYGYNKZVZXOP-UHFFFAOYSA-N
XLogP1.85
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine?
The IUPAC name of 6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine (CID 3058702) is 6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine.
What is the SMILES notation for 6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine?
The canonical SMILES for 6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine is c1cnc2c(c1)CN(CC1CC1)CC2.
What is the InChIKey of 6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine?
The InChIKey is BPIYGYNKZVZXOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-2-11-9-14(8-10-3-4-10)7-5-12(11)13-6-1/h1-2,6,10H,3-5,7-9H2.
What are the key properties of 6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine?
6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine has a molecular weight of 188.27 g/mol, XLogP of 1.85, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethyl)-7,8-dihydro-5H-1,6-naphthyridine is sourced from PubChem (CID 3058702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).