[1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol

C11H19N3O — CID 79479607

IUPAC[1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol
SMILESCCn1cc(CNCC2(CO)CC2)cn1
InChIInChI=1S/C11H19N3O/c1-2-14-7-10(6-13-14)5-12-8-11(9-15)3-4-11/h6-7,12,15H,2-5,8-9H2,1H3
InChIKeyJYXCCFXNVXILDR-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.77
Rot. Bonds6

About [1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol

[1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol (PubChem CID 79479607) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is [1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol
PubChem CID79479607
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name[1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol
SMILESCCn1cc(CNCC2(CO)CC2)cn1
InChIInChI=1S/C11H19N3O/c1-2-14-7-10(6-13-14)5-12-8-11(9-15)3-4-11/h6-7,12,15H,2-5,8-9H2,1H3
InChIKeyJYXCCFXNVXILDR-UHFFFAOYSA-N
XLogP0.77
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-ethylcyclopentyl)methyl]-1-(1-ethylpyrazol-4-yl)methanamine
CID 103766160
N-[[1-(chloromethyl)cyclohexyl]methyl]-1-(1-ethylpyrazol-4-yl)methanamine
CID 113359893
1-(1-ethylpyrazol-4-yl)-N-[(1-methylcyclohexyl)methyl]methanamine
CID 103753080
N-[[1-[(1-ethylpyrazol-4-yl)methyl]cyclopropyl]methyl]propan-1-amine
CID 66024888
N-[[1-[(1-ethylpyrazol-4-yl)methyl]cyclobutyl]methyl]ethanamine
CID 65194929
1-(1-ethylpyrazol-4-yl)-N-[(3-methyloxetan-3-yl)methyl]methanamine
CID 78957579
N-[(1-ethylcyclobutyl)methyl]-1-(1-propylpyrazol-4-yl)methanamine
CID 103741109
1-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]cyclobutan-1-amine
CID 115673834
1-(1-ethylpyrazol-4-yl)-N-[(1-propylpyrazol-4-yl)methyl]methanamine
CID 122166789
4-[[(1-ethylpyrazol-4-yl)methylamino]methyl]phenol
CID 19627439
N-[[1-[(1-ethylpyrazol-4-yl)methyl]cyclobutyl]methyl]propan-2-amine
CID 65194328
N-[(1-ethylpyrazol-4-yl)methyl]-1-(4-methylcyclohexyl)methanamine
CID 63243485

Frequently Asked Questions

What is the IUPAC name of [1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol (CID 79479607) is [1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol is CCn1cc(CNCC2(CO)CC2)cn1.
What is the InChIKey of [1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol?
The InChIKey is JYXCCFXNVXILDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-2-14-7-10(6-13-14)5-12-8-11(9-15)3-4-11/h6-7,12,15H,2-5,8-9H2,1H3.
What are the key properties of [1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol?
[1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol has a molecular weight of 209.29 g/mol, XLogP of 0.77, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(1-ethylpyrazol-4-yl)methylamino]methyl]cyclopropyl]methanol is sourced from PubChem (CID 79479607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).