2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

C7H8ClN3 — CID 10241226

IUPAC2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESNc1nc(Cl)nc2c1CCC2
InChIInChI=1S/C7H8ClN3/c8-7-10-5-3-1-2-4(5)6(9)11-7/h1-3H2,(H2,9,10,11)
InChIKeyFLSZZRQYAPQBEO-UHFFFAOYSA-N
MW169.62 g/mol
LogP1.20
Rot. Bonds

About 2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 10241226) has the molecular formula C7H8ClN3 and a molecular weight of 169.62 g/mol. Its IUPAC name is 2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID10241226
Molecular FormulaC7H8ClN3
Molecular Weight169.62 g/mol
Exact Mass169.04
IUPAC Name2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESNc1nc(Cl)nc2c1CCC2
InChIInChI=1S/C7H8ClN3/c8-7-10-5-3-1-2-4(5)6(9)11-7/h1-3H2,(H2,9,10,11)
InChIKeyFLSZZRQYAPQBEO-UHFFFAOYSA-N
XLogP1.20
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.62
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of 2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 10241226) is 2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for 2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for 2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is Nc1nc(Cl)nc2c1CCC2.
What is the InChIKey of 2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is FLSZZRQYAPQBEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClN3/c8-7-10-5-3-1-2-4(5)6(9)11-7/h1-3H2,(H2,9,10,11).
What are the key properties of 2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 169.62 g/mol, XLogP of 1.20, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 10241226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).