5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine

C9H11N3 — CID 134181285

IUPAC5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine
SMILESC=C1NC(N)=NC2=C1C(C)=CC2
InChIInChI=1S/C9H11N3/c1-5-3-4-7-8(5)6(2)11-9(10)12-7/h3H,2,4H2,1H3,(H3,10,11,12)
InChIKeyCSOTVOHONJEUCA-UHFFFAOYSA-N
MW161.21 g/mol
LogP1.02
Rot. Bonds

About 5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine

5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine (PubChem CID 134181285) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is 5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine.

Molecular Properties

Compound Name5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine
PubChem CID134181285
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC Name5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine
SMILESC=C1NC(N)=NC2=C1C(C)=CC2
InChIInChI=1S/C9H11N3/c1-5-3-4-7-8(5)6(2)11-9(10)12-7/h3H,2,4H2,1H3,(H3,10,11,12)
InChIKeyCSOTVOHONJEUCA-UHFFFAOYSA-N
XLogP1.02
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methylidene-4,5-di(propan-2-yl)-1H-pyrimidin-2-amine
CID 68238807
1-(6-methylcyclohexa-1,3-dien-1-yl)-2-[(3E)-4-methylhexa-1,3,5-trien-3-yl]guanidine
CID 89098625
7-Methyl-4-methylidene-3,7a-dihydrocyclopenta[d]pyrimidin-2-amine
CID 118446164
5,7-Dimethyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine
CID 134181666
1,2-Bis(6-methylidenecyclohexa-1,3-dien-1-yl)guanidine
CID 139687703
2-methyl-1-[(3E,5Z)-2-methylhepta-1,3,5-trien-3-yl]guanidine
CID 144190799
1H-cyclohepta[d]pyrimidine-2,4-diamine
CID 153822746
5-[(Z)-but-2-en-2-yl]-4-methyl-6-methylidene-1H-pyrimidin-2-amine
CID 155072452
3a-Methyl-1,4-dihydrobenzimidazol-2-amine
CID 160709605
8,9-dihydro-1H-perimidin-2-amine
CID 163722852
CID 173881206
CID 173881206
5-Ethyl-1,4-dimethyl-6-methylidenepyrimidin-2-amine
CID 129938173

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine?
The IUPAC name of 5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine (CID 134181285) is 5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine.
What is the SMILES notation for 5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine?
The canonical SMILES for 5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine is C=C1NC(N)=NC2=C1C(C)=CC2.
What is the InChIKey of 5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine?
The InChIKey is CSOTVOHONJEUCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3/c1-5-3-4-7-8(5)6(2)11-9(10)12-7/h3H,2,4H2,1H3,(H3,10,11,12).
What are the key properties of 5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine?
5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine has a molecular weight of 161.21 g/mol, XLogP of 1.02, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-methylidene-3,7-dihydrocyclopenta[d]pyrimidin-2-amine is sourced from PubChem (CID 134181285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).