N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine

C10H19N3O2 — CID 116793712

IUPACN-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine
SMILESCOCCNCC(C)Oc1cnn(C)c1
InChIInChI=1S/C10H19N3O2/c1-9(6-11-4-5-14-3)15-10-7-12-13(2)8-10/h7-9,11H,4-6H2,1-3H3
InChIKeyYPFJKTABJCZYTL-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.42
Rot. Bonds7

About N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine

N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine (PubChem CID 116793712) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine
PubChem CID116793712
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC NameN-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine
SMILESCOCCNCC(C)Oc1cnn(C)c1
InChIInChI=1S/C10H19N3O2/c1-9(6-11-4-5-14-3)15-10-7-12-13(2)8-10/h7-9,11H,4-6H2,1-3H3
InChIKeyYPFJKTABJCZYTL-UHFFFAOYSA-N
XLogP0.42
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-N-[2-(1-methylpyrazol-4-yl)oxyethyl]ethanamine
CID 116793733
2-(1-methylpyrazol-4-yl)oxy-N-(thiophen-2-ylmethyl)propan-1-amine
CID 116793711
N-(2-methoxyethyl)-2-(4-propylphenoxy)propan-1-amine
CID 62584394
2-(1-methylpyrazol-4-yl)oxy-N-propylpentan-1-amine
CID 116793605
2-methoxy-N-[(1-methylpyrazol-4-yl)methyl]ethanamine;hydrochloride
CID 126966602
2-benzyl-N-(2-methoxyethyl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 62725650
3-methyl-N-[2-(1-methylpyrazol-4-yl)oxyethyl]butan-2-amine
CID 116793697
2-(4-butylphenoxy)-N-(2-methoxyethyl)propan-1-amine
CID 115493375
N-(2-methoxyethyl)-2-[4-(2-methylbutan-2-yl)phenoxy]propan-1-amine
CID 62571520
2-(4-bromo-3-methylphenoxy)-N-(2-methoxyethyl)propan-1-amine
CID 83140097
N-(3-methoxypropyl)-2-pyridin-3-yloxypropan-1-amine
CID 62583823
N',N'-dimethyl-N-[2-(1-methylpyrazol-4-yl)oxyethyl]ethane-1,2-diamine
CID 116793723

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine?
The IUPAC name of N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine (CID 116793712) is N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine.
What is the SMILES notation for N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine?
The canonical SMILES for N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine is COCCNCC(C)Oc1cnn(C)c1.
What is the InChIKey of N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine?
The InChIKey is YPFJKTABJCZYTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-9(6-11-4-5-14-3)15-10-7-12-13(2)8-10/h7-9,11H,4-6H2,1-3H3.
What are the key properties of N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine?
N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine has a molecular weight of 213.28 g/mol, XLogP of 0.42, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)oxypropan-1-amine is sourced from PubChem (CID 116793712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).