N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine

C12H24N4 — CID 103569442

IUPACN-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine
SMILESCCCN(CC)C(CN)c1cnn(CC)c1
InChIInChI=1S/C12H24N4/c1-4-7-15(5-2)12(8-13)11-9-14-16(6-3)10-11/h9-10,12H,4-8,13H2,1-3H3
InChIKeyRTIJGBBQKFWJNM-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.63
Rot. Bonds7

About N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine

N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine (PubChem CID 103569442) has the molecular formula C12H24N4 and a molecular weight of 224.35 g/mol. Its IUPAC name is N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine.

Molecular Properties

Compound NameN-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine
PubChem CID103569442
Molecular FormulaC12H24N4
Molecular Weight224.35 g/mol
Exact Mass224.20
IUPAC NameN-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine
SMILESCCCN(CC)C(CN)c1cnn(CC)c1
InChIInChI=1S/C12H24N4/c1-4-7-15(5-2)12(8-13)11-9-14-16(6-3)10-11/h9-10,12H,4-8,13H2,1-3H3
InChIKeyRTIJGBBQKFWJNM-UHFFFAOYSA-N
XLogP1.63
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-(1-ethylpyrazol-4-yl)-N-methylethane-1,2-diamine
CID 103569436
2-amino-1-(1-ethylpyrazol-4-yl)ethanol
CID 55264385
N,N-dibutyl-1-(1-methylpyrazol-4-yl)ethane-1,2-diamine
CID 43125888
1-(1-ethylpyrazol-4-yl)-N-methyl-N-(2-phenylethyl)ethane-1,2-diamine
CID 103569668
N-ethyl-1-(4-methylphenyl)-N-propylethane-1,2-diamine
CID 43268554
N-ethyl-1-(4-ethylphenyl)-N-propylethane-1,2-diamine
CID 43268550
1-(1-ethylpyrazol-4-yl)-N-methyl-N-(pyridin-4-ylmethyl)ethane-1,2-diamine
CID 103569459
N-(cyclohexylmethyl)-1-(1-ethylpyrazol-4-yl)-N-methylethane-1,2-diamine
CID 103569513
1-(1-ethylpyrazol-4-yl)-N-methyl-N-(3-methylphenyl)ethane-1,2-diamine
CID 103569563
N-benzyl-N-ethyl-1-(1-methylpyrazol-4-yl)ethane-1,2-diamine
CID 43126047
1-(1-ethylpyrazol-4-yl)-N-methyl-N-[(6-methyl-2-pyridinyl)methyl]ethane-1,2-diamine
CID 103569698
N-methyl-N-(4-methylpentan-2-yl)-1-(1-propylpyrazol-4-yl)ethane-1,2-diamine
CID 103571806

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine?
The IUPAC name of N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine (CID 103569442) is N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine.
What is the SMILES notation for N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine?
The canonical SMILES for N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine is CCCN(CC)C(CN)c1cnn(CC)c1.
What is the InChIKey of N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine?
The InChIKey is RTIJGBBQKFWJNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4/c1-4-7-15(5-2)12(8-13)11-9-14-16(6-3)10-11/h9-10,12H,4-8,13H2,1-3H3.
What are the key properties of N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine?
N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine has a molecular weight of 224.35 g/mol, XLogP of 1.63, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(1-ethylpyrazol-4-yl)-N-propylethane-1,2-diamine is sourced from PubChem (CID 103569442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).