(4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol

C9H15N3O — CID 112714748

IUPAC(4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol
SMILESCc1c2c(nn1C)CCC2(N)CO
InChIInChI=1S/C9H15N3O/c1-6-8-7(11-12(6)2)3-4-9(8,10)5-13/h13H,3-5,10H2,1-2H3
InChIKeyDMXLSIVHNSLNSM-UHFFFAOYSA-N
MW181.24 g/mol
LogP-0.18
Rot. Bonds1

About (4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol

(4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol (PubChem CID 112714748) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is (4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol.

Molecular Properties

Compound Name(4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol
PubChem CID112714748
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name(4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol
SMILESCc1c2c(nn1C)CCC2(N)CO
InChIInChI=1S/C9H15N3O/c1-6-8-7(11-12(6)2)3-4-9(8,10)5-13/h13H,3-5,10H2,1-2H3
InChIKeyDMXLSIVHNSLNSM-UHFFFAOYSA-N
XLogP-0.18
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol
CID 105434429
(4-Fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-yl)methanol
CID 105441106
(1-Ethyl-4-fluoro-4-methyl-5,6-dihydrocyclopenta[c]pyrazol-3-yl)methanol
CID 105451484
(4-Fluoro-4-methyl-1-propan-2-yl-5,6-dihydrocyclopenta[c]pyrazol-3-yl)methanol
CID 105465992
(2-Methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol
CID 68716056
3-Cyclopentapyrazolemethanol, 1,4,5,6-tetrahydro-1-methyl-
CID 68792181
[1-Amino-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol
CID 79581209
[1-Amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol
CID 79581440
[1-Amino-3-(3,4,5-trimethylpyrazol-1-yl)cyclopentyl]methanol
CID 79645016
[1-Amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)cyclopentyl]methanol
CID 79646258
3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol
CID 83854580
(4-amino-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-yl)methanol
CID 83905572

Frequently Asked Questions

What is the IUPAC name of (4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol?
The IUPAC name of (4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol (CID 112714748) is (4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol.
What is the SMILES notation for (4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol?
The canonical SMILES for (4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol is Cc1c2c(nn1C)CCC2(N)CO.
What is the InChIKey of (4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol?
The InChIKey is DMXLSIVHNSLNSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-6-8-7(11-12(6)2)3-4-9(8,10)5-13/h13H,3-5,10H2,1-2H3.
What are the key properties of (4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol?
(4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol has a molecular weight of 181.24 g/mol, XLogP of -0.18, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol is sourced from PubChem (CID 112714748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).