2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol

C9H15N3O — CID 105439525

IUPAC2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol
SMILESNC1(Cc2cnn(CCO)c2)CC1
InChIInChI=1S/C9H15N3O/c10-9(1-2-9)5-8-6-11-12(7-8)3-4-13/h6-7,13H,1-5,10H2
InChIKeyWWYOZAYYFWUZGD-UHFFFAOYSA-N
MW181.24 g/mol
LogP-0.09
Rot. Bonds4

About 2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol

2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol (PubChem CID 105439525) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol
PubChem CID105439525
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol
SMILESNC1(Cc2cnn(CCO)c2)CC1
InChIInChI=1S/C9H15N3O/c10-9(1-2-9)5-8-6-11-12(7-8)3-4-13/h6-7,13H,1-5,10H2
InChIKeyWWYOZAYYFWUZGD-UHFFFAOYSA-N
XLogP-0.09
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(1-ethylpyrazol-4-yl)methyl]-4,4-dimethylcycloheptan-1-amine
CID 65083823
2-[4-[[(1-methylcyclopentyl)amino]methyl]pyrazol-1-yl]ethanol
CID 64830027
2-[4-[2-(1-aminocyclopropyl)ethyl]pyrazol-1-yl]acetic acid
CID 105462924
2-[4-[[[2-(dimethylamino)-2-methylpropyl]amino]methyl]pyrazol-1-yl]ethanol
CID 64830339
4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine
CID 62126227
1-[[1-(2-hydroxyethyl)pyrazol-4-yl]methyl]-3-methylpyrrolidine-3-carboxylic acid
CID 65063923
2-[4-[[4-(2-aminoethyl)piperidin-1-yl]methyl]pyrazol-1-yl]ethanol
CID 64830712
2-[4-[[(1-methylpiperidin-4-yl)methylamino]methyl]pyrazol-1-yl]ethanol
CID 64830590
2-(4-chloropyrazol-1-yl)ethanol
CID 7172186
1-[2-(4-bromopyrazol-1-yl)ethyl]cyclopropan-1-amine
CID 84693286
1-[[1-(2-hydroxyethyl)pyrazol-4-yl]methyl]-3-methylpiperidine-3-carboxylic acid
CID 65068621
2-[4-[(2-phenylethylamino)methyl]pyrazol-1-yl]ethanol
CID 64830530

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol?
The IUPAC name of 2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol (CID 105439525) is 2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol is NC1(Cc2cnn(CCO)c2)CC1.
What is the InChIKey of 2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol?
The InChIKey is WWYOZAYYFWUZGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c10-9(1-2-9)5-8-6-11-12(7-8)3-4-13/h6-7,13H,1-5,10H2.
What are the key properties of 2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol?
2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol has a molecular weight of 181.24 g/mol, XLogP of -0.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(1-aminocyclopropyl)methyl]pyrazol-1-yl]ethanol is sourced from PubChem (CID 105439525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).