[2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate

C24H26N4O3 — CID 68899919

About [2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate

[2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate (PubChem CID 68899919) has the molecular formula C24H26N4O3 and a molecular weight of 418.50 g/mol. Its IUPAC name is [2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate.

Molecular Properties

• Compound Name: [2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate
• PubChem CID: 68899919
• Molecular Formula: C24H26N4O3
• Molecular Weight: 418.50 g/mol
• Exact Mass: 418.20
• IUPAC Name: [2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate
• SMILES: C=CCN(C)C(=O)Oc1c(N(C)C(=O)c2cccc3ccccc23)nc2n1CCCC2
• InChI: InChI=1S/C24H26N4O3/c1-4-15-26(2)24(30)31-23-21(25-20-14-7-8-16-28(20)23)27(3)22(29)19-13-9-11-17-10-5-6-12-18(17)19/h4-6,9-13H,1,7-8,14-16H2,2-3H3
• InChIKey: VIVGOTUHQNEGDI-UHFFFAOYSA-N
• XLogP: 4.27
• TPSA: 67.67 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	418.50
LogP ≤ 5	4.27
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate?

The IUPAC name of [2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate (CID 68899919) is [2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate.

What is the SMILES notation for [2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate?

The canonical SMILES for [2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate is C=CCN(C)C(=O)Oc1c(N(C)C(=O)c2cccc3ccccc23)nc2n1CCCC2.

What is the InChIKey of [2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate?

The InChIKey is VIVGOTUHQNEGDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O3/c1-4-15-26(2)24(30)31-23-21(25-20-14-7-8-16-28(20)23)27(3)22(29)19-13-9-11-17-10-5-6-12-18(17)19/h4-6,9-13H,1,7-8,14-16H2,2-3H3.

What are the key properties of [2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate?

[2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate has a molecular weight of 418.50 g/mol, XLogP of 4.27, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for [2-[methyl(naphthalene-1-carbonyl)amino]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl] N-methyl-N-prop-2-enylcarbamate is sourced from PubChem (CID 68899919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).