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

C17H23N7 — CID 118731838

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESc1c(Nc2nc(N3CCNCC3)nc3c2CCC3)n[nH]c1C1CC1
InChIInChI=1S/C17H23N7/c1-2-12-13(3-1)19-17(24-8-6-18-7-9-24)21-16(12)20-15-10-14(22-23-15)11-4-5-11/h10-11,18H,1-9H2,(H2,19,20,21,22,23)
InChIKeyHHEFOBAOJHQKBS-UHFFFAOYSA-N
MW325.42 g/mol
LogP1.72
Rot. Bonds4

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

N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 118731838) has the molecular formula C17H23N7 and a molecular weight of 325.42 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID118731838
Molecular FormulaC17H23N7
Molecular Weight325.42 g/mol
Exact Mass325.20
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESc1c(Nc2nc(N3CCNCC3)nc3c2CCC3)n[nH]c1C1CC1
InChIInChI=1S/C17H23N7/c1-2-12-13(3-1)19-17(24-8-6-18-7-9-24)21-16(12)20-15-10-14(22-23-15)11-4-5-11/h10-11,18H,1-9H2,(H2,19,20,21,22,23)
InChIKeyHHEFOBAOJHQKBS-UHFFFAOYSA-N
XLogP1.72
TPSA81.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.42
LogP ≤ 51.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 118731838) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-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-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is c1c(Nc2nc(N3CCNCC3)nc3c2CCC3)n[nH]c1C1CC1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is HHEFOBAOJHQKBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N7/c1-2-12-13(3-1)19-17(24-8-6-18-7-9-24)21-16(12)20-15-10-14(22-23-15)11-4-5-11/h10-11,18H,1-9H2,(H2,19,20,21,22,23).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 325.42 g/mol, XLogP of 1.72, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 118731838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).