N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane

C18H19N5O — CID 142447667

IUPACN-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane
SMILESC1CC1.Cc1ccncc1-c1cc2cc(NC=O)ncc2c(N)n1
InChIInChI=1S/C15H13N5O.C3H6/c1-9-2-3-17-6-11(9)13-4-10-5-14(19-8-21)18-7-12(10)15(16)20-13;1-2-3-1/h2-8H,1H3,(H2,16,20)(H,18,19,21);1-3H2
InChIKeyFESNJFMWVVPZPC-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.32
Rot. Bonds3

About N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane

N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane (PubChem CID 142447667) has the molecular formula C18H19N5O and a molecular weight of 321.38 g/mol. Its IUPAC name is N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane.

Molecular Properties

Compound NameN-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane
PubChem CID142447667
Molecular FormulaC18H19N5O
Molecular Weight321.38 g/mol
Exact Mass321.16
IUPAC NameN-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane
SMILESC1CC1.Cc1ccncc1-c1cc2cc(NC=O)ncc2c(N)n1
InChIInChI=1S/C15H13N5O.C3H6/c1-9-2-3-17-6-11(9)13-4-10-5-14(19-8-21)18-7-12(10)15(16)20-13;1-2-3-1/h2-8H,1H3,(H2,16,20)(H,18,19,21);1-3H2
InChIKeyFESNJFMWVVPZPC-UHFFFAOYSA-N
XLogP3.32
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane?
The IUPAC name of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane (CID 142447667) is N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane.
What is the SMILES notation for N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane?
The canonical SMILES for N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane is C1CC1.Cc1ccncc1-c1cc2cc(NC=O)ncc2c(N)n1.
What is the InChIKey of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane?
The InChIKey is FESNJFMWVVPZPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O.C3H6/c1-9-2-3-17-6-11(9)13-4-10-5-14(19-8-21)18-7-12(10)15(16)20-13;1-2-3-1/h2-8H,1H3,(H2,16,20)(H,18,19,21);1-3H2.
What are the key properties of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane?
N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane has a molecular weight of 321.38 g/mol, XLogP of 3.32, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane is sourced from PubChem (CID 142447667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).