2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol

C13H24N4O — CID 66011474

IUPAC2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol
SMILESCCn1nc(C)c(N)c1N(CCO)C1CCCC1
InChIInChI=1S/C13H24N4O/c1-3-17-13(12(14)10(2)15-17)16(8-9-18)11-6-4-5-7-11/h11,18H,3-9,14H2,1-2H3
InChIKeyMZYPWLNQBHOGCU-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.53
Rot. Bonds5

About 2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol

2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol (PubChem CID 66011474) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol.

Molecular Properties

Compound Name2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol
PubChem CID66011474
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol
SMILESCCn1nc(C)c(N)c1N(CCO)C1CCCC1
InChIInChI=1S/C13H24N4O/c1-3-17-13(12(14)10(2)15-17)16(8-9-18)11-6-4-5-7-11/h11,18H,3-9,14H2,1-2H3
InChIKeyMZYPWLNQBHOGCU-UHFFFAOYSA-N
XLogP1.53
TPSA67.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(4-amino-1,3-dimethylpyrazol-5-yl)-cyclohexylamino]ethanol
CID 54993676
3-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopropylamino]propanenitrile
CID 66011476
5-N-cyclohexyl-5-N-ethyl-3-methyl-1-propylpyrazole-4,5-diamine
CID 66013691
1-ethyl-5-N,3-dimethyl-5-N-(4-methylcyclohexyl)pyrazole-4,5-diamine
CID 66011851
1-ethyl-5-N-(4-ethylcyclohexyl)-5-N,3-dimethylpyrazole-4,5-diamine
CID 66013415
5-N-(cyclopropylmethyl)-1-ethyl-5-N,3-dimethylpyrazole-4,5-diamine
CID 66011650
2-[cyclobutyl-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]amino]ethanol
CID 102864919
[1-(4-amino-1-ethyl-3-methylpyrazol-5-yl)piperidin-3-yl]methanol
CID 66012620
2-[(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)-cyclopentylamino]acetamide
CID 66027381
1-ethyl-5-N,3-dimethyl-5-N-[(1-methylpiperidin-4-yl)methyl]pyrazole-4,5-diamine
CID 66011883
5-[cyclopropyl(2-hydroxyethyl)amino]-1,3-dimethylpyrazole-4-carbothioamide
CID 63757564
1-ethyl-5-N,3-dimethyl-5-N-(4-methylpentan-2-yl)pyrazole-4,5-diamine
CID 66011670

Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol?
The IUPAC name of 2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol (CID 66011474) is 2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol.
What is the SMILES notation for 2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol?
The canonical SMILES for 2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol is CCn1nc(C)c(N)c1N(CCO)C1CCCC1.
What is the InChIKey of 2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol?
The InChIKey is MZYPWLNQBHOGCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-3-17-13(12(14)10(2)15-17)16(8-9-18)11-6-4-5-7-11/h11,18H,3-9,14H2,1-2H3.
What are the key properties of 2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol?
2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol has a molecular weight of 252.36 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol is sourced from PubChem (CID 66011474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).