2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide

C13H25N5O — CID 79584534

IUPAC2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide
SMILESCCN(CC)CCNC(C(N)=O)c1cnn(C)c1C
InChIInChI=1S/C13H25N5O/c1-5-18(6-2)8-7-15-12(13(14)19)11-9-16-17(4)10(11)3/h9,12,15H,5-8H2,1-4H3,(H2,14,19)
InChIKeyUWOKUANGLORRBZ-UHFFFAOYSA-N
MW267.38 g/mol
LogP0.19
Rot. Bonds8

About 2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide

2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide (PubChem CID 79584534) has the molecular formula C13H25N5O and a molecular weight of 267.38 g/mol. Its IUPAC name is 2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide
PubChem CID79584534
Molecular FormulaC13H25N5O
Molecular Weight267.38 g/mol
Exact Mass267.21
IUPAC Name2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide
SMILESCCN(CC)CCNC(C(N)=O)c1cnn(C)c1C
InChIInChI=1S/C13H25N5O/c1-5-18(6-2)8-7-15-12(13(14)19)11-9-16-17(4)10(11)3/h9,12,15H,5-8H2,1-4H3,(H2,14,19)
InChIKeyUWOKUANGLORRBZ-UHFFFAOYSA-N
XLogP0.19
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-[2-(dimethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetate
CID 79584636
2-[2-(diethylamino)ethylamino]-2-(2-hydroxyphenyl)acetamide
CID 116684899
2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide
CID 54941562
2-anilino-2-(1,5-dimethylpyrazol-4-yl)acetamide
CID 79583885
2-(1,5-dimethylpyrazol-4-yl)-2-(2-methoxyethylamino)acetic acid
CID 79583704
2-(1,5-dimethylpyrazol-4-yl)-2-(3-fluoro-5-methylanilino)acetamide
CID 79583974
ethyl 2-[2-(diethylamino)ethylamino]-2-(3-methylimidazol-4-yl)acetate
CID 66117956
2-[2-(diethylamino)ethylamino]-2-(1-propylpyrazol-4-yl)acetic acid
CID 103572149
methyl 2-(1,5-dimethylpyrazol-4-yl)-2-(prop-2-ynylamino)acetate
CID 79583513
3-[1-(1,5-dimethylpyrazol-4-yl)ethylamino]propanoic acid
CID 155858515
5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide
CID 82546931
ethyl 3-(1,5-dimethylpyrazol-4-yl)-3-(ethylamino)propanoate
CID 79595467

Frequently Asked Questions

What is the IUPAC name of 2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide?
The IUPAC name of 2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide (CID 79584534) is 2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide.
What is the SMILES notation for 2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide?
The canonical SMILES for 2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide is CCN(CC)CCNC(C(N)=O)c1cnn(C)c1C.
What is the InChIKey of 2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide?
The InChIKey is UWOKUANGLORRBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N5O/c1-5-18(6-2)8-7-15-12(13(14)19)11-9-16-17(4)10(11)3/h9,12,15H,5-8H2,1-4H3,(H2,14,19).
What are the key properties of 2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide?
2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide has a molecular weight of 267.38 g/mol, XLogP of 0.19, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide is sourced from PubChem (CID 79584534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).