7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine

C11H17N3 — CID 129262022

IUPAC7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine
SMILESCN1CCCC2c3nccn3CCC21
InChIInChI=1S/C11H17N3/c1-13-6-2-3-9-10(13)4-7-14-8-5-12-11(9)14/h5,8-10H,2-4,6-7H2,1H3
InChIKeyMSGMOBOLYZNODU-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.46
Rot. Bonds

About 7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine

7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine (PubChem CID 129262022) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine.

Molecular Properties

Compound Name7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine
PubChem CID129262022
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine
SMILESCN1CCCC2c3nccn3CCC21
InChIInChI=1S/C11H17N3/c1-13-6-2-3-9-10(13)4-7-14-8-5-12-11(9)14/h5,8-10H,2-4,6-7H2,1H3
InChIKeyMSGMOBOLYZNODU-UHFFFAOYSA-N
XLogP1.46
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine?
The IUPAC name of 7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine (CID 129262022) is 7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine.
What is the SMILES notation for 7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine?
The canonical SMILES for 7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine is CN1CCCC2c3nccn3CCC21.
What is the InChIKey of 7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine?
The InChIKey is MSGMOBOLYZNODU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-13-6-2-3-9-10(13)4-7-14-8-5-12-11(9)14/h5,8-10H,2-4,6-7H2,1H3.
What are the key properties of 7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine?
7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine has a molecular weight of 191.28 g/mol, XLogP of 1.46, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-6,6a,8,9,10,10a-hexahydro-5H-imidazo[2,1-f][1,6]naphthyridine is sourced from PubChem (CID 129262022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).