2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide

C18H19N5O3 — CID 59022902

IUPAC2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide
SMILESCOCc1cccc(CNC(=O)c2cc(-c3ccc(C)o3)nc(N)n2)n1
InChIInChI=1S/C18H19N5O3/c1-11-6-7-16(26-11)14-8-15(23-18(19)22-14)17(24)20-9-12-4-3-5-13(21-12)10-25-2/h3-8H,9-10H2,1-2H3,(H,20,24)(H2,19,22,23)
InChIKeyBYSIVQPGLDCHRU-UHFFFAOYSA-N
MW353.38 g/mol
LogP2.10
Rot. Bonds6

About 2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide

2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide (PubChem CID 59022902) has the molecular formula C18H19N5O3 and a molecular weight of 353.38 g/mol. Its IUPAC name is 2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide
PubChem CID59022902
Molecular FormulaC18H19N5O3
Molecular Weight353.38 g/mol
Exact Mass353.15
IUPAC Name2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide
SMILESCOCc1cccc(CNC(=O)c2cc(-c3ccc(C)o3)nc(N)n2)n1
InChIInChI=1S/C18H19N5O3/c1-11-6-7-16(26-11)14-8-15(23-18(19)22-14)17(24)20-9-12-4-3-5-13(21-12)10-25-2/h3-8H,9-10H2,1-2H3,(H,20,24)(H2,19,22,23)
InChIKeyBYSIVQPGLDCHRU-UHFFFAOYSA-N
XLogP2.10
TPSA116.16 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide (CID 59022902) is 2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide is COCc1cccc(CNC(=O)c2cc(-c3ccc(C)o3)nc(N)n2)n1.
What is the InChIKey of 2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide?
The InChIKey is BYSIVQPGLDCHRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O3/c1-11-6-7-16(26-11)14-8-15(23-18(19)22-14)17(24)20-9-12-4-3-5-13(21-12)10-25-2/h3-8H,9-10H2,1-2H3,(H,20,24)(H2,19,22,23).
What are the key properties of 2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide?
2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide has a molecular weight of 353.38 g/mol, XLogP of 2.10, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide is sourced from PubChem (CID 59022902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).