N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

C18H24N6 — CID 118731839

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESc1c(Nc2nc(N3CCCCC3)nc3c2CCC3)n[nH]c1C1CC1
InChIInChI=1S/C18H24N6/c1-2-9-24(10-3-1)18-19-14-6-4-5-13(14)17(21-18)20-16-11-15(22-23-16)12-7-8-12/h11-12H,1-10H2,(H2,19,20,21,22,23)
InChIKeyVXKHQUPJOUMJSC-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.30
Rot. Bonds4

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 118731839) has the molecular formula C18H24N6 and a molecular weight of 324.43 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID118731839
Molecular FormulaC18H24N6
Molecular Weight324.43 g/mol
Exact Mass324.21
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESc1c(Nc2nc(N3CCCCC3)nc3c2CCC3)n[nH]c1C1CC1
InChIInChI=1S/C18H24N6/c1-2-9-24(10-3-1)18-19-14-6-4-5-13(14)17(21-18)20-16-11-15(22-23-16)12-7-8-12/h11-12H,1-10H2,(H2,19,20,21,22,23)
InChIKeyVXKHQUPJOUMJSC-UHFFFAOYSA-N
XLogP3.30
TPSA69.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 118731839) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is c1c(Nc2nc(N3CCCCC3)nc3c2CCC3)n[nH]c1C1CC1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is VXKHQUPJOUMJSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6/c1-2-9-24(10-3-1)18-19-14-6-4-5-13(14)17(21-18)20-16-11-15(22-23-16)12-7-8-12/h11-12H,1-10H2,(H2,19,20,21,22,23).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 324.43 g/mol, XLogP of 3.30, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperidin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 118731839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).