5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine

C14H26N4O — CID 66012447

IUPAC5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine
SMILESCCn1nc(C)c(N)c1N(CCOC)C(C)C1CC1
InChIInChI=1S/C14H26N4O/c1-5-18-14(13(15)10(2)16-18)17(8-9-19-4)11(3)12-6-7-12/h11-12H,5-9,15H2,1-4H3
InChIKeyZMDZHYHIHMDICS-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.04
Rot. Bonds7

About 5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine

5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine (PubChem CID 66012447) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine.

Molecular Properties

Compound Name5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine
PubChem CID66012447
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine
SMILESCCn1nc(C)c(N)c1N(CCOC)C(C)C1CC1
InChIInChI=1S/C14H26N4O/c1-5-18-14(13(15)10(2)16-18)17(8-9-19-4)11(3)12-6-7-12/h11-12H,5-9,15H2,1-4H3
InChIKeyZMDZHYHIHMDICS-UHFFFAOYSA-N
XLogP2.04
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-N-(2-methoxyethyl)-3-methyl-5-N-pentan-3-yl-1-propylpyrazole-4,5-diamine
CID 66028997
5-[1-cyclopropylethyl(2-methoxyethyl)amino]-1,3-dimethylpyrazole-4-carbaldehyde
CID 55003982
5-N-(2-methoxyethyl)-1,3-dimethyl-5-N-propan-2-ylpyrazole-4,5-diamine
CID 82948167
1-ethyl-5-N,3-dimethyl-5-N-(4-methylcyclohexyl)pyrazole-4,5-diamine
CID 66011851
3-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-propan-2-ylamino]propanenitrile
CID 66011475
2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine
CID 80820940
1-ethyl-5-N-(4-ethylcyclohexyl)-5-N,3-dimethylpyrazole-4,5-diamine
CID 66013415
5-N-(cyclopropylmethyl)-1-ethyl-5-N,3-dimethylpyrazole-4,5-diamine
CID 66011650
1-N-(1-cyclopropylethyl)-1-N-(2-methoxyethyl)-4-methylbenzene-1,2-diamine
CID 55004687
1-ethyl-5-N,3-dimethyl-5-N-(3-methylbutan-2-yl)pyrazole-4,5-diamine
CID 66013014
2-[(4-amino-1-ethyl-3-methylpyrazol-5-yl)-cyclopentylamino]ethanol
CID 66011474
4-N-(1-cyclopropylethyl)-4-N-(2-methoxyethyl)-2-propoxybenzene-1,4-diamine
CID 63676257

Frequently Asked Questions

What is the IUPAC name of 5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine?
The IUPAC name of 5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine (CID 66012447) is 5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine.
What is the SMILES notation for 5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine?
The canonical SMILES for 5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine is CCn1nc(C)c(N)c1N(CCOC)C(C)C1CC1.
What is the InChIKey of 5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine?
The InChIKey is ZMDZHYHIHMDICS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-5-18-14(13(15)10(2)16-18)17(8-9-19-4)11(3)12-6-7-12/h11-12H,5-9,15H2,1-4H3.
What are the key properties of 5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine?
5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine has a molecular weight of 266.39 g/mol, XLogP of 2.04, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine is sourced from PubChem (CID 66012447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).