N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide

C18H21N5O3 — CID 15454127

IUPACN-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide
SMILESCc1nc(N)ccc1CNC(=O)Cn1c(C)cc2c(c1=O)NC(=O)CC2
InChIInChI=1S/C18H21N5O3/c1-10-7-12-4-6-15(24)22-17(12)18(26)23(10)9-16(25)20-8-13-3-5-14(19)21-11(13)2/h3,5,7H,4,6,8-9H2,1-2H3,(H2,19,21)(H,20,25)(H,22,24)
InChIKeyGZLSRIOJUOYOBV-UHFFFAOYSA-N
MW355.40 g/mol
LogP0.64
Rot. Bonds4

About N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide

N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide (PubChem CID 15454127) has the molecular formula C18H21N5O3 and a molecular weight of 355.40 g/mol. Its IUPAC name is N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide.

Molecular Properties

Compound NameN-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide
PubChem CID15454127
Molecular FormulaC18H21N5O3
Molecular Weight355.40 g/mol
Exact Mass355.16
IUPAC NameN-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide
SMILESCc1nc(N)ccc1CNC(=O)Cn1c(C)cc2c(c1=O)NC(=O)CC2
InChIInChI=1S/C18H21N5O3/c1-10-7-12-4-6-15(24)22-17(12)18(26)23(10)9-16(25)20-8-13-3-5-14(19)21-11(13)2/h3,5,7H,4,6,8-9H2,1-2H3,(H2,19,21)(H,20,25)(H,22,24)
InChIKeyGZLSRIOJUOYOBV-UHFFFAOYSA-N
XLogP0.64
TPSA119.11 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.40
LogP ≤ 50.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide?
The IUPAC name of N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide (CID 15454127) is N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide.
What is the SMILES notation for N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide?
The canonical SMILES for N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide is Cc1nc(N)ccc1CNC(=O)Cn1c(C)cc2c(c1=O)NC(=O)CC2.
What is the InChIKey of N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide?
The InChIKey is GZLSRIOJUOYOBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O3/c1-10-7-12-4-6-15(24)22-17(12)18(26)23(10)9-16(25)20-8-13-3-5-14(19)21-11(13)2/h3,5,7H,4,6,8-9H2,1-2H3,(H2,19,21)(H,20,25)(H,22,24).
What are the key properties of N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide?
N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide has a molecular weight of 355.40 g/mol, XLogP of 0.64, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-(6-methyl-2,8-dioxo-3,4-dihydro-1H-1,7-naphthyridin-7-yl)acetamide is sourced from PubChem (CID 15454127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).