1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine

C17H31N3 — CID 105002712

IUPAC1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine
SMILESCCCNC(Cc1cc(C)nn1CC)CC1CCCC1
InChIInChI=1S/C17H31N3/c1-4-10-18-16(12-15-8-6-7-9-15)13-17-11-14(3)19-20(17)5-2/h11,15-16,18H,4-10,12-13H2,1-3H3
InChIKeyUHOACDNPBQXIFF-UHFFFAOYSA-N
MW277.46 g/mol
LogP3.70
Rot. Bonds8

About 1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine

1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine (PubChem CID 105002712) has the molecular formula C17H31N3 and a molecular weight of 277.46 g/mol. Its IUPAC name is 1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine
PubChem CID105002712
Molecular FormulaC17H31N3
Molecular Weight277.46 g/mol
Exact Mass277.25
IUPAC Name1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine
SMILESCCCNC(Cc1cc(C)nn1CC)CC1CCCC1
InChIInChI=1S/C17H31N3/c1-4-10-18-16(12-15-8-6-7-9-15)13-17-11-14(3)19-20(17)5-2/h11,15-16,18H,4-10,12-13H2,1-3H3
InChIKeyUHOACDNPBQXIFF-UHFFFAOYSA-N
XLogP3.70
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.46
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-3-(2,5-dimethylpyrazol-3-yl)-N-propylpropan-2-amine
CID 104996236
1-(2-ethyl-5-methylpyrazol-3-yl)-3-[(2-methylpropan-2-yl)oxy]-N-propylpropan-2-amine
CID 105162436
5-ethoxy-1-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpentan-2-amine
CID 105162468
1-(1,3-diethylpyrazol-5-yl)-3-(oxolan-3-yl)-N-propylpropan-2-amine
CID 103987467
1-(2-ethyl-5-methylpyrazol-3-yl)-5-methoxy-4-methyl-N-propylpentan-2-amine
CID 105162393
N-[1-(1,1-dioxothiolan-3-yl)-2-(2-ethyl-5-methylpyrazol-3-yl)ethyl]propan-1-amine
CID 115337039
N-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-(1-methylcyclohexyl)ethyl]propan-1-amine
CID 106830290
[2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylcyclohexyl)ethyl]hydrazine
CID 105232165
2-cyclohexyl-1-(2-ethyl-5-methylpyrazol-3-yl)ethanamine
CID 105135780
N-[(3-ethylcyclohexyl)-(2-ethyl-5-methylpyrazol-3-yl)methyl]propan-1-amine
CID 105156057
1-cyclopentyl-3-(2,6-dimethylphenyl)-N-propylpropan-2-amine
CID 105024576
1-cyclopentyl-3-(2-methyl-1,3-thiazol-4-yl)-N-propylpropan-2-amine
CID 62797585

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine?
The IUPAC name of 1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine (CID 105002712) is 1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine.
What is the SMILES notation for 1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine?
The canonical SMILES for 1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine is CCCNC(Cc1cc(C)nn1CC)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine?
The InChIKey is UHOACDNPBQXIFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N3/c1-4-10-18-16(12-15-8-6-7-9-15)13-17-11-14(3)19-20(17)5-2/h11,15-16,18H,4-10,12-13H2,1-3H3.
What are the key properties of 1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine?
1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine has a molecular weight of 277.46 g/mol, XLogP of 3.70, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(2-ethyl-5-methylpyrazol-3-yl)-N-propylpropan-2-amine is sourced from PubChem (CID 105002712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).