N-methyl-N-(1,3,5-triazin-2-yl)formamide

C5H6N4O — CID 54024989

IUPACN-methyl-N-(1,3,5-triazin-2-yl)formamide
SMILESCN(C=O)c1ncncn1
InChIInChI=1S/C5H6N4O/c1-9(4-10)5-7-2-6-3-8-5/h2-4H,1H3
InChIKeyNZPXQPQIFPHOQX-UHFFFAOYSA-N
MW138.13 g/mol
LogP-0.54
Rot. Bonds2

About N-methyl-N-(1,3,5-triazin-2-yl)formamide

N-methyl-N-(1,3,5-triazin-2-yl)formamide (PubChem CID 54024989) has the molecular formula C5H6N4O and a molecular weight of 138.13 g/mol. Its IUPAC name is N-methyl-N-(1,3,5-triazin-2-yl)formamide.

Molecular Properties

Compound NameN-methyl-N-(1,3,5-triazin-2-yl)formamide
PubChem CID54024989
Molecular FormulaC5H6N4O
Molecular Weight138.13 g/mol
Exact Mass138.05
IUPAC NameN-methyl-N-(1,3,5-triazin-2-yl)formamide
SMILESCN(C=O)c1ncncn1
InChIInChI=1S/C5H6N4O/c1-9(4-10)5-7-2-6-3-8-5/h2-4H,1H3
InChIKeyNZPXQPQIFPHOQX-UHFFFAOYSA-N
XLogP-0.54
TPSA58.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.13
LogP ≤ 5-0.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Formaldehyde;1,3,5-triazine
CID 19901968
2-Methoxy-4-dimethylamino-1,3,5-triazine
CID 20209895
N-[4-(dimethylamino)-6-fluoro-1,3,5-triazin-2-yl]-N-methylformamide
CID 173426731
N-sym-triazinyl-N-cyanourea
CID 129798978
Pentamethyl-N-formylmelamine
CID 358715
Formaldehyde;1,3,5-triazin-2-amine
CID 18544388
N-(4,6-dichloro-1,3,5-triazin-2-yl)-N-methylformamide
CID 19736187
1-Methyl-1-(1,3,5-triazin-2-yl)urea
CID 19758518
N-[4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl]-N-methylformamide
CID 20036841
N-(1,3,5-triazin-2-yl)formamide
CID 23335062
N-(4,6-diamino-1,3,5-triazin-2-yl)-N-methylformamide
CID 54332868
1-Methyl-3-(1,3,5-triazin-2-yl)urea
CID 59731135

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1,3,5-triazin-2-yl)formamide?
The IUPAC name of N-methyl-N-(1,3,5-triazin-2-yl)formamide (CID 54024989) is N-methyl-N-(1,3,5-triazin-2-yl)formamide.
What is the SMILES notation for N-methyl-N-(1,3,5-triazin-2-yl)formamide?
The canonical SMILES for N-methyl-N-(1,3,5-triazin-2-yl)formamide is CN(C=O)c1ncncn1.
What is the InChIKey of N-methyl-N-(1,3,5-triazin-2-yl)formamide?
The InChIKey is NZPXQPQIFPHOQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N4O/c1-9(4-10)5-7-2-6-3-8-5/h2-4H,1H3.
What are the key properties of N-methyl-N-(1,3,5-triazin-2-yl)formamide?
N-methyl-N-(1,3,5-triazin-2-yl)formamide has a molecular weight of 138.13 g/mol, XLogP of -0.54, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1,3,5-triazin-2-yl)formamide is sourced from PubChem (CID 54024989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).