4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine

C11H15N3 — CID 3245831

IUPAC4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine
SMILESC=C(C)C1Cc2nc(N)nc(C)c2C1
InChIInChI=1S/C11H15N3/c1-6(2)8-4-9-7(3)13-11(12)14-10(9)5-8/h8H,1,4-5H2,2-3H3,(H2,12,13,14)
InChIKeySJUHHZQYXMFGRA-UHFFFAOYSA-N
MW189.26 g/mol
LogP1.66
Rot. Bonds1

About 4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine

4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine (PubChem CID 3245831) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine
PubChem CID3245831
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine
SMILESC=C(C)C1Cc2nc(N)nc(C)c2C1
InChIInChI=1S/C11H15N3/c1-6(2)8-4-9-7(3)13-11(12)14-10(9)5-8/h8H,1,4-5H2,2-3H3,(H2,12,13,14)
InChIKeySJUHHZQYXMFGRA-UHFFFAOYSA-N
XLogP1.66
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine?
The IUPAC name of 4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine (CID 3245831) is 4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine.
What is the SMILES notation for 4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine?
The canonical SMILES for 4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine is C=C(C)C1Cc2nc(N)nc(C)c2C1.
What is the InChIKey of 4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine?
The InChIKey is SJUHHZQYXMFGRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-6(2)8-4-9-7(3)13-11(12)14-10(9)5-8/h8H,1,4-5H2,2-3H3,(H2,12,13,14).
What are the key properties of 4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine?
4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine has a molecular weight of 189.26 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-prop-1-en-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine is sourced from PubChem (CID 3245831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).