2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide

C17H16N4O2 — CID 54850982

IUPAC2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide
SMILESCc1nc(N)nc(COc2ccc3ccccc3c2)c1C(N)=O
InChIInChI=1S/C17H16N4O2/c1-10-15(16(18)22)14(21-17(19)20-10)9-23-13-7-6-11-4-2-3-5-12(11)8-13/h2-8H,9H2,1H3,(H2,18,22)(H2,19,20,21)
InChIKeyNJDLPUPQQXRQOC-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.20
Rot. Bonds4

About 2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide

2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide (PubChem CID 54850982) has the molecular formula C17H16N4O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is 2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide
PubChem CID54850982
Molecular FormulaC17H16N4O2
Molecular Weight308.34 g/mol
Exact Mass308.13
IUPAC Name2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide
SMILESCc1nc(N)nc(COc2ccc3ccccc3c2)c1C(N)=O
InChIInChI=1S/C17H16N4O2/c1-10-15(16(18)22)14(21-17(19)20-10)9-23-13-7-6-11-4-2-3-5-12(11)8-13/h2-8H,9H2,1H3,(H2,18,22)(H2,19,20,21)
InChIKeyNJDLPUPQQXRQOC-UHFFFAOYSA-N
XLogP2.20
TPSA104.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxylic acid
CID 54851615
2-amino-4-methyl-6-[(4-methylphenoxy)methyl]pyrimidine-5-carboxamide
CID 54851072
2-amino-4-[(3-ethylphenoxy)methyl]-6-methylpyrimidine-5-carboxamide
CID 54850457
2-amino-4-[(4-chloro-3,5-dimethylphenoxy)methyl]-6-methylpyrimidine-5-carboxamide
CID 54850622
2-amino-4-[(4-bromo-2-methylphenoxy)methyl]-6-methylpyrimidine-5-carboxamide
CID 54850715
2-amino-4-[(4-chlorophenoxy)methyl]-6-methylpyrimidine-5-carboxylic acid
CID 54851309
2-amino-N,4-dimethyl-6-[(4-phenylphenoxy)methyl]pyrimidine-5-carboxamide
CID 54854022
ethyl 2-amino-4-[(4-methoxyphenoxy)methyl]-6-methylpyrimidine-5-carboxylate
CID 54851405
2-amino-N-ethyl-4-methyl-6-[(3-methylphenoxy)methyl]pyrimidine-5-carboxamide
CID 54853624
6-(naphthalen-2-yloxymethyl)-1,3,5-triazine-2,4-diamine
CID 9137806
2-amino-4-[(2-methoxyphenoxy)methyl]-6-methylpyrimidine-5-carbohydrazide
CID 54851833
3,5-dimethyl-2-(naphthalen-2-yloxymethyl)pyridin-4-amine
CID 103183022

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide?
The IUPAC name of 2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide (CID 54850982) is 2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide.
What is the SMILES notation for 2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide?
The canonical SMILES for 2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide is Cc1nc(N)nc(COc2ccc3ccccc3c2)c1C(N)=O.
What is the InChIKey of 2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide?
The InChIKey is NJDLPUPQQXRQOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O2/c1-10-15(16(18)22)14(21-17(19)20-10)9-23-13-7-6-11-4-2-3-5-12(11)8-13/h2-8H,9H2,1H3,(H2,18,22)(H2,19,20,21).
What are the key properties of 2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide?
2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide has a molecular weight of 308.34 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxamide is sourced from PubChem (CID 54850982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).