4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol

C9H15N3O — CID 83906527

IUPAC4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol
SMILESCn1ncc2c1CCC2(O)CCN
InChIInChI=1S/C9H15N3O/c1-12-8-2-3-9(13,4-5-10)7(8)6-11-12/h6,13H,2-5,10H2,1H3
InChIKeyRASMTCDTYKESCL-UHFFFAOYSA-N
MW181.24 g/mol
LogP-0.10
Rot. Bonds2

About 4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol

4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol (PubChem CID 83906527) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol.

Molecular Properties

Compound Name4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol
PubChem CID83906527
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol
SMILESCn1ncc2c1CCC2(O)CCN
InChIInChI=1S/C9H15N3O/c1-12-8-2-3-9(13,4-5-10)7(8)6-11-12/h6,13H,2-5,10H2,1H3
InChIKeyRASMTCDTYKESCL-UHFFFAOYSA-N
XLogP-0.10
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-Alumanyl-5-fluoro-4-methyl-5,6-dihydrocyclopenta[c]pyrazol-4-ol
CID 164087205
1-Methyl-1,4,5,6-tetrahydrocyclopenta[C]pyrazol-4-OL
CID 162341864
6-(1,5-Dimethylpyrazol-4-yl)bicyclo[3.1.0]hexan-6-ol
CID 79331244
1-(1,5-Dimethylpyrazol-4-yl)-2-propylcyclopropan-1-ol
CID 79333181
[1-(Aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol
CID 79595356
3-Amino-1-(2-methylpyrazol-3-yl)cyclopentan-1-ol
CID 80561783
4-Amino-2-(1,3-dimethylpyrazol-4-yl)butan-2-ol
CID 82407070
4-Amino-2-(1,5-dimethylpyrazol-4-yl)butan-2-ol
CID 82407071
3-(2-aminoethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-ol
CID 83863530
4-(aminomethyl)-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-ol
CID 83905084
4-(aminomethyl)-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-ol
CID 83905564
4-(Aminomethyl)-2-methyl-5,6-dihydrocyclopenta[c]pyrazol-4-ol
CID 83905568

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol?
The IUPAC name of 4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol (CID 83906527) is 4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol.
What is the SMILES notation for 4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol?
The canonical SMILES for 4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol is Cn1ncc2c1CCC2(O)CCN.
What is the InChIKey of 4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol?
The InChIKey is RASMTCDTYKESCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-12-8-2-3-9(13,4-5-10)7(8)6-11-12/h6,13H,2-5,10H2,1H3.
What are the key properties of 4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol?
4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol has a molecular weight of 181.24 g/mol, XLogP of -0.10, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethyl)-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol is sourced from PubChem (CID 83906527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).