N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide

C7H10N4O — CID 597195

IUPACN-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide
SMILESCc1ncc(CNC=O)c(N)n1
InChIInChI=1S/C7H10N4O/c1-5-10-3-6(2-9-4-12)7(8)11-5/h3-4H,2H2,1H3,(H,9,12)(H2,8,10,11)
InChIKeyPVWNFAGYFUUDRC-UHFFFAOYSA-N
MW166.18 g/mol
LogP-0.39
Rot. Bonds3

About N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide

N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide (PubChem CID 597195) has the molecular formula C7H10N4O and a molecular weight of 166.18 g/mol. Its IUPAC name is N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide.

Molecular Properties

Compound NameN-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide
PubChem CID597195
Molecular FormulaC7H10N4O
Molecular Weight166.18 g/mol
Exact Mass166.09
IUPAC NameN-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide
SMILESCc1ncc(CNC=O)c(N)n1
InChIInChI=1S/C7H10N4O/c1-5-10-3-6(2-9-4-12)7(8)11-5/h3-4H,2H2,1H3,(H,9,12)(H2,8,10,11)
InChIKeyPVWNFAGYFUUDRC-UHFFFAOYSA-N
XLogP-0.39
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide 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 N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide?
The IUPAC name of N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide (CID 597195) is N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide.
What is the SMILES notation for N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide?
The canonical SMILES for N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide is Cc1ncc(CNC=O)c(N)n1.
What is the InChIKey of N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide?
The InChIKey is PVWNFAGYFUUDRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O/c1-5-10-3-6(2-9-4-12)7(8)11-5/h3-4H,2H2,1H3,(H,9,12)(H2,8,10,11).
What are the key properties of N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide?
N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide has a molecular weight of 166.18 g/mol, XLogP of -0.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide is sourced from PubChem (CID 597195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).