[1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol

C12H21N3O — CID 79595356

IUPAC[1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol
SMILESCc1c(C(O)C2(CN)CCCC2)cnn1C
InChIInChI=1S/C12H21N3O/c1-9-10(7-14-15(9)2)11(16)12(8-13)5-3-4-6-12/h7,11,16H,3-6,8,13H2,1-2H3
InChIKeyMAMZWPPTBPAHCN-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.28
Rot. Bonds3

About [1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol

[1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol (PubChem CID 79595356) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is [1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol.

Molecular Properties

Compound Name[1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol
PubChem CID79595356
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name[1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol
SMILESCc1c(C(O)C2(CN)CCCC2)cnn1C
InChIInChI=1S/C12H21N3O/c1-9-10(7-14-15(9)2)11(16)12(8-13)5-3-4-6-12/h7,11,16H,3-6,8,13H2,1-2H3
InChIKeyMAMZWPPTBPAHCN-UHFFFAOYSA-N
XLogP1.28
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1,1,1-Trifluoro-2-[5-(2-methylbutan-2-yl)-1-propan-2-ylpyrazol-4-yl]propan-2-ol
CID 126758601
1-(1,5-Dimethylpyrazol-4-yl)-4,4,4-trifluorobutan-1-ol
CID 79584950
1-(3-tert-butyl-1-methyl-1H-pyrazol-4-yl)-2,2-difluoroethan-1-ol
CID 83091093
1-(1,3-Dimethylpyrazol-4-yl)-4,4,4-trifluorobutan-1-ol
CID 83091280
1-(3-Tert-butyl-1-methylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol
CID 83091644
1-(1,3-Dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol
CID 83091660
1-(3-tert-butyl-1-methyl-1H-pyrazol-4-yl)-2,2,2-trifluoroethan-1-ol
CID 83092071
1-(3-Tert-butyl-1-methylpyrazol-4-yl)-4,4,4-trifluorobutan-1-ol
CID 83092250
(1R)-3-amino-1-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]propan-1-ol
CID 96886695
(1S)-3-amino-1-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]propan-1-ol
CID 96886696
1-(3-Ethyl-1-methylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol
CID 112670336
1-(3-Ethyl-1-methylpyrazol-4-yl)-4,4,4-trifluorobutan-1-ol
CID 112670389

Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol?
The IUPAC name of [1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol (CID 79595356) is [1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol.
What is the SMILES notation for [1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol?
The canonical SMILES for [1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol is Cc1c(C(O)C2(CN)CCCC2)cnn1C.
What is the InChIKey of [1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol?
The InChIKey is MAMZWPPTBPAHCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-9-10(7-14-15(9)2)11(16)12(8-13)5-3-4-6-12/h7,11,16H,3-6,8,13H2,1-2H3.
What are the key properties of [1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol?
[1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol has a molecular weight of 223.32 g/mol, XLogP of 1.28, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)cyclopentyl]-(1,5-dimethylpyrazol-4-yl)methanol is sourced from PubChem (CID 79595356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).