2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine

C9H17N3O — CID 63974690

IUPAC2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine
SMILESCCCn1nccc1C(N)COC
InChIInChI=1S/C9H17N3O/c1-3-6-12-9(4-5-11-12)8(10)7-13-2/h4-5,8H,3,6-7,10H2,1-2H3
InChIKeyICATXGBOYFTNSQ-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.94
Rot. Bonds5

About 2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine

2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine (PubChem CID 63974690) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine.

Molecular Properties

Compound Name2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine
PubChem CID63974690
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine
SMILESCCCn1nccc1C(N)COC
InChIInChI=1S/C9H17N3O/c1-3-6-12-9(4-5-11-12)8(10)7-13-2/h4-5,8H,3,6-7,10H2,1-2H3
InChIKeyICATXGBOYFTNSQ-UHFFFAOYSA-N
XLogP0.94
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl (3R)-3-amino-3-(2-propylpyrazol-3-yl)propanoate
CID 104939468
1-(2-propylpyrazol-3-yl)hexan-1-amine
CID 115857677
(1S)-3,3,3-trifluoro-1-(2-propylpyrazol-3-yl)propan-1-amine
CID 104941104
4,4,4-trifluoro-1-(2-propylpyrazol-3-yl)butan-1-amine
CID 79952578
[3-methoxy-1-(2-propylpyrazol-3-yl)propyl]hydrazine
CID 105206275
(1S)-2-methoxy-1-(3-propyltriazol-4-yl)ethanamine
CID 165459865
2,2-dimethyl-1-(2-propylpyrazol-3-yl)propan-1-amine
CID 63975935
1-(4-chloro-1-propylpyrazol-5-yl)-2-methoxyethanamine
CID 114648638
[2-ethyl-2-methoxy-1-(2-propylpyrazol-3-yl)butyl]hydrazine
CID 105275317
2-(3,5-difluorophenyl)-1-(2-propylpyrazol-3-yl)ethanamine
CID 63977023
2-amino-1-(2-propylpyrazol-3-yl)propane-1,3-diol
CID 114558108
1-(2-ethylpyrazol-3-yl)-3-propoxypropan-1-amine
CID 105148342

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine?
The IUPAC name of 2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine (CID 63974690) is 2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine.
What is the SMILES notation for 2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine?
The canonical SMILES for 2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine is CCCn1nccc1C(N)COC.
What is the InChIKey of 2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine?
The InChIKey is ICATXGBOYFTNSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-3-6-12-9(4-5-11-12)8(10)7-13-2/h4-5,8H,3,6-7,10H2,1-2H3.
What are the key properties of 2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine?
2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine has a molecular weight of 183.25 g/mol, XLogP of 0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(2-propylpyrazol-3-yl)ethanamine is sourced from PubChem (CID 63974690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).