6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine

C7H10N4 — CID 143480405

IUPAC6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine
SMILESC=C1C=CN=C(N)N1/C=N/C
InChIInChI=1S/C7H10N4/c1-6-3-4-10-7(8)11(6)5-9-2/h3-5H,1H2,2H3,(H2,8,10)/b9-5+
InChIKeyKXIVATLHWPURFM-WEVVVXLNSA-N
MW150.18 g/mol
LogP0.30
Rot. Bonds1

About 6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine

6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine (PubChem CID 143480405) has the molecular formula C7H10N4 and a molecular weight of 150.18 g/mol. Its IUPAC name is 6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine
PubChem CID143480405
Molecular FormulaC7H10N4
Molecular Weight150.18 g/mol
Exact Mass150.09
IUPAC Name6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine
SMILESC=C1C=CN=C(N)N1/C=N/C
InChIInChI=1S/C7H10N4/c1-6-3-4-10-7(8)11(6)5-9-2/h3-5H,1H2,2H3,(H2,8,10)/b9-5+
InChIKeyKXIVATLHWPURFM-WEVVVXLNSA-N
XLogP0.30
TPSA53.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1-Methyl-6-methylidene-1,6-dihydropyrimidine
CID 57831095
3-Methyl-3,4-dihydro-2(1H)-pyrimidinimin
CID 91165700
3,4-Dihydro-3-methyl-4-pyrimidinamine
CID 45116685
4H-pyrimidine-3-carboximidamide
CID 22629403
1-Methyl-4-methylidenepyrimidine
CID 57672168
1-Ethyl-4-methylidenepyrimidine
CID 57672220
6-methylidene-1-[(Z)-prop-1-enyl]pyrimidine
CID 117913361
(N-hexa-2,4-dien-3-yl-N'-methylcarbamimidoyl)-methylidene-(1-methyl-2H-pyridin-5-yl)azanium
CID 123392654
(6Z)-6-ethylidene-1-methylpyrimidine
CID 135253879
N'-(2-amino-6-methylidene-1H-pyrimidin-5-yl)-N,N-dimethylmethanimidamide
CID 141790554
N-methyl-4-methylidene-1H-pyrimidin-2-imine
CID 148467007
1-methyl-6-methylidene-N-prop-1-en-2-ylpyrimidin-4-amine
CID 155001988

Frequently Asked Questions

What is the IUPAC name of 6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine?
The IUPAC name of 6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine (CID 143480405) is 6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine.
What is the SMILES notation for 6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine?
The canonical SMILES for 6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine is C=C1C=CN=C(N)N1/C=N/C.
What is the InChIKey of 6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine?
The InChIKey is KXIVATLHWPURFM-WEVVVXLNSA-N. The full InChI is InChI=1S/C7H10N4/c1-6-3-4-10-7(8)11(6)5-9-2/h3-5H,1H2,2H3,(H2,8,10)/b9-5+.
What are the key properties of 6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine?
6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine has a molecular weight of 150.18 g/mol, XLogP of 0.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylidene-1-(methyliminomethyl)pyrimidin-2-amine is sourced from PubChem (CID 143480405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).