carbamic acid;1,3,5-triazine

C4H6N4O2 — CID 22075585

IUPACcarbamic acid;1,3,5-triazine
SMILESNC(=O)O.c1ncncn1
InChIInChI=1S/C3H3N3.CH3NO2/c1-4-2-6-3-5-1;2-1(3)4/h1-3H;2H2,(H,3,4)
InChIKeyCGUVJGHPTPONBB-UHFFFAOYSA-N
MW142.12 g/mol
LogP-0.51
Rot. Bonds

About carbamic acid;1,3,5-triazine

carbamic acid;1,3,5-triazine (PubChem CID 22075585) has the molecular formula C4H6N4O2 and a molecular weight of 142.12 g/mol. Its IUPAC name is carbamic acid;1,3,5-triazine.

Molecular Properties

Compound Namecarbamic acid;1,3,5-triazine
PubChem CID22075585
Molecular FormulaC4H6N4O2
Molecular Weight142.12 g/mol
Exact Mass142.05
IUPAC Namecarbamic acid;1,3,5-triazine
SMILESNC(=O)O.c1ncncn1
InChIInChI=1S/C3H3N3.CH3NO2/c1-4-2-6-3-5-1;2-1(3)4/h1-3H;2H2,(H,3,4)
InChIKeyCGUVJGHPTPONBB-UHFFFAOYSA-N
XLogP-0.51
TPSA101.99 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.12
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-carboxy-N-sym-triazinyl-O-methylisourea
CID 129798727
methyl N-(1,3,5-triazin-2-yl)carbamate
CID 19704296
1,3,5-Triazin-2-ylcarbamic acid
CID 20077889
Methyl carbamate;1,3,5-triazine
CID 21253744
Carbamic acid;1,3,5-triazine
CID 23297040
1,3,5-Triazin-2-yl carbamate
CID 53641296
1,3,5-triazin-2-yl N-methylcarbamate
CID 54003672
1,3,5-Triazine;urea
CID 67443877
[4-(Carbamoylamino)-1,3,5-triazin-2-yl]urea
CID 68655116
1,3,5-Triazine;urea
CID 69330981
Methyl(1,3,5-triazin-2-yl)carbamic acid
CID 69335538
Carbamic acid;1,3,5-triazin-2-amine
CID 69340479

Frequently Asked Questions

What is the IUPAC name of carbamic acid;1,3,5-triazine?
The IUPAC name of carbamic acid;1,3,5-triazine (CID 22075585) is carbamic acid;1,3,5-triazine.
What is the SMILES notation for carbamic acid;1,3,5-triazine?
The canonical SMILES for carbamic acid;1,3,5-triazine is NC(=O)O.c1ncncn1.
What is the InChIKey of carbamic acid;1,3,5-triazine?
The InChIKey is CGUVJGHPTPONBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3N3.CH3NO2/c1-4-2-6-3-5-1;2-1(3)4/h1-3H;2H2,(H,3,4).
What are the key properties of carbamic acid;1,3,5-triazine?
carbamic acid;1,3,5-triazine has a molecular weight of 142.12 g/mol, XLogP of -0.51, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbamic acid;1,3,5-triazine is sourced from PubChem (CID 22075585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).