2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine

C8H13N3 — CID 83872534

IUPAC2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine
SMILESNCCC1CCc2cn[nH]c21
InChIInChI=1S/C8H13N3/c9-4-3-6-1-2-7-5-10-11-8(6)7/h5-6H,1-4,9H2,(H,10,11)
InChIKeyPIACPTSLGXRCTI-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.79
Rot. Bonds2

About 2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine

2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine (PubChem CID 83872534) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine.

Molecular Properties

Compound Name2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine
PubChem CID83872534
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine
SMILESNCCC1CCc2cn[nH]c21
InChIInChI=1S/C8H13N3/c9-4-3-6-1-2-7-5-10-11-8(6)7/h5-6H,1-4,9H2,(H,10,11)
InChIKeyPIACPTSLGXRCTI-UHFFFAOYSA-N
XLogP0.79
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)acetic acid
CID 82414310
2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-4-yl)ethanamine
CID 83861633
2-(4,5,6,7-tetrahydro-1,2-benzoxazol-7-yl)ethanamine
CID 83873526
(6,6-dimethyl-1,4,5,7-tetrahydroindazol-7-yl)methanamine
CID 112714625
5-(2-aminoethyl)-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one
CID 83861735
2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine
CID 83843148
7-(2-aminoethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol
CID 112715402
3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol
CID 83827747
1-(4,5,6,7-tetrahydro-1H-indazol-7-yl)azetidin-3-amine
CID 82402462
N'-(5-cyclohexyl-1H-pyrazol-4-yl)ethane-1,2-diamine
CID 117209801
2-(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-yl)ethanamine
CID 83861581
N-[(2,3-dichloro-4-fluorophenyl)methyl]-4,5,6,7-tetrahydro-1H-indazol-7-amine
CID 166229001

Frequently Asked Questions

What is the IUPAC name of 2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine?
The IUPAC name of 2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine (CID 83872534) is 2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine.
What is the SMILES notation for 2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine?
The canonical SMILES for 2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine is NCCC1CCc2cn[nH]c21.
What is the InChIKey of 2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine?
The InChIKey is PIACPTSLGXRCTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c9-4-3-6-1-2-7-5-10-11-8(6)7/h5-6H,1-4,9H2,(H,10,11).
What are the key properties of 2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine?
2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine has a molecular weight of 151.21 g/mol, XLogP of 0.79, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine is sourced from PubChem (CID 83872534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).