4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine

C9H15N5 — CID 174329466

IUPAC4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine
SMILESC=CN(C)c1ncn(C)/c(=N\C)c1N
InChIInChI=1S/C9H15N5/c1-5-13(3)9-7(10)8(11-2)14(4)6-12-9/h5-6H,1,10H2,2-4H3/b11-8-
InChIKeySFLMXWKHHXXEEE-FLIBITNWSA-N
MW193.25 g/mol
LogP0.11
Rot. Bonds2

About 4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine

4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine (PubChem CID 174329466) has the molecular formula C9H15N5 and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine.

Molecular Properties

Compound Name4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine
PubChem CID174329466
Molecular FormulaC9H15N5
Molecular Weight193.25 g/mol
Exact Mass193.13
IUPAC Name4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine
SMILESC=CN(C)c1ncn(C)/c(=N\C)c1N
InChIInChI=1S/C9H15N5/c1-5-13(3)9-7(10)8(11-2)14(4)6-12-9/h5-6H,1,10H2,2-4H3/b11-8-
InChIKeySFLMXWKHHXXEEE-FLIBITNWSA-N
XLogP0.11
TPSA59.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine?
The IUPAC name of 4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine (CID 174329466) is 4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine.
What is the SMILES notation for 4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine?
The canonical SMILES for 4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine is C=CN(C)c1ncn(C)/c(=N\C)c1N.
What is the InChIKey of 4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine?
The InChIKey is SFLMXWKHHXXEEE-FLIBITNWSA-N. The full InChI is InChI=1S/C9H15N5/c1-5-13(3)9-7(10)8(11-2)14(4)6-12-9/h5-6H,1,10H2,2-4H3/b11-8-.
What are the key properties of 4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine?
4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine has a molecular weight of 193.25 g/mol, XLogP of 0.11, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-ethenyl-4-N,1-dimethyl-6-methyliminopyrimidine-4,5-diamine is sourced from PubChem (CID 174329466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).