4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine

C17H26N4O — CID 82171697

IUPAC4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine
SMILESCCCN(CCC)Cc1cnn(-c2ccccc2OC)c1N
InChIInChI=1S/C17H26N4O/c1-4-10-20(11-5-2)13-14-12-19-21(17(14)18)15-8-6-7-9-16(15)22-3/h6-9,12H,4-5,10-11,13,18H2,1-3H3
InChIKeyXBEVZVXPRVPBAO-UHFFFAOYSA-N
MW302.42 g/mol
LogP3.09
Rot. Bonds8

About 4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine

4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine (PubChem CID 82171697) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is 4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine.

Molecular Properties

Compound Name4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine
PubChem CID82171697
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC Name4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine
SMILESCCCN(CCC)Cc1cnn(-c2ccccc2OC)c1N
InChIInChI=1S/C17H26N4O/c1-4-10-20(11-5-2)13-14-12-19-21(17(14)18)15-8-6-7-9-16(15)22-3/h6-9,12H,4-5,10-11,13,18H2,1-3H3
InChIKeyXBEVZVXPRVPBAO-UHFFFAOYSA-N
XLogP3.09
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(dipropylamino)methyl]-1-(4-methoxyphenyl)pyrazol-5-amine
CID 82171687
N-[[5-ethyl-1-(2-methoxyphenyl)pyrazol-4-yl]methyl]ethanamine
CID 66441179
[1-(2-methoxyphenyl)-5-propan-2-ylpyrazol-4-yl]methanamine
CID 66440981
[5-amino-1-(2-methoxyphenyl)pyrazol-4-yl] carbamate
CID 67041372
N-[[1-(2-methoxyphenyl)-5-propylpyrazol-4-yl]methyl]propan-2-amine
CID 66440776
[1-(2-methoxyphenyl)-5-(trifluoromethyl)pyrazol-4-yl]methanamine
CID 66440778
4-(chloromethyl)-1-(2-methoxyphenyl)-5-propan-2-ylpyrazole
CID 66438831
4-iodo-1-(2-methoxyphenyl)-3-methylpyrazol-5-amine
CID 63035065
[2-(2-methoxyphenyl)pyrazol-3-yl]methanamine
CID 83881539
N'-benzyl-N'-[[2-(2-methoxyphenyl)pyrazol-3-yl]methyl]ethane-1,2-diamine
CID 120844312
2-[[2-methoxyethyl(propyl)amino]methyl]aniline
CID 43459932
5-ethyl-1-(2-methoxyphenyl)tetrazole
CID 23117976

Frequently Asked Questions

What is the IUPAC name of 4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine?
The IUPAC name of 4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine (CID 82171697) is 4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine.
What is the SMILES notation for 4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine?
The canonical SMILES for 4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine is CCCN(CCC)Cc1cnn(-c2ccccc2OC)c1N.
What is the InChIKey of 4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine?
The InChIKey is XBEVZVXPRVPBAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c1-4-10-20(11-5-2)13-14-12-19-21(17(14)18)15-8-6-7-9-16(15)22-3/h6-9,12H,4-5,10-11,13,18H2,1-3H3.
What are the key properties of 4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine?
4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine has a molecular weight of 302.42 g/mol, XLogP of 3.09, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dipropylamino)methyl]-1-(2-methoxyphenyl)pyrazol-5-amine is sourced from PubChem (CID 82171697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).