N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine

C8H13N3 — CID 55265291

IUPACN,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine
SMILESCNc1n[nH]c2c1CC(C)C2
InChIInChI=1S/C8H13N3/c1-5-3-6-7(4-5)10-11-8(6)9-2/h5H,3-4H2,1-2H3,(H2,9,10,11)
InChIKeyXDVLTQFDXNLTPZ-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.19
Rot. Bonds1

About N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine

N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine (PubChem CID 55265291) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine.

Molecular Properties

Compound NameN,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine
PubChem CID55265291
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC NameN,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine
SMILESCNc1n[nH]c2c1CC(C)C2
InChIInChI=1S/C8H13N3/c1-5-3-6-7(4-5)10-11-8(6)9-2/h5H,3-4H2,1-2H3,(H2,9,10,11)
InChIKeyXDVLTQFDXNLTPZ-UHFFFAOYSA-N
XLogP1.19
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine?
The IUPAC name of N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine (CID 55265291) is N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine.
What is the SMILES notation for N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine?
The canonical SMILES for N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine is CNc1n[nH]c2c1CC(C)C2.
What is the InChIKey of N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine?
The InChIKey is XDVLTQFDXNLTPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-5-3-6-7(4-5)10-11-8(6)9-2/h5H,3-4H2,1-2H3,(H2,9,10,11).
What are the key properties of N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine?
N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine has a molecular weight of 151.21 g/mol, XLogP of 1.19, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine is sourced from PubChem (CID 55265291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).