1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine

C14H20N4 — CID 62687876

IUPAC1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine
SMILESCc1ccc(-c2cc(N)n(CCN(C)C)n2)cc1
InChIInChI=1S/C14H20N4/c1-11-4-6-12(7-5-11)13-10-14(15)18(16-13)9-8-17(2)3/h4-7,10H,8-9,15H2,1-3H3
InChIKeyGIUAZZOPSAILKC-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.00
Rot. Bonds4

About 1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine

1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine (PubChem CID 62687876) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine
PubChem CID62687876
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine
SMILESCc1ccc(-c2cc(N)n(CCN(C)C)n2)cc1
InChIInChI=1S/C14H20N4/c1-11-4-6-12(7-5-11)13-10-14(15)18(16-13)9-8-17(2)3/h4-7,10H,8-9,15H2,1-3H3
InChIKeyGIUAZZOPSAILKC-UHFFFAOYSA-N
XLogP2.00
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine (CID 62687876) is 1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine is Cc1ccc(-c2cc(N)n(CCN(C)C)n2)cc1.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine?
The InChIKey is GIUAZZOPSAILKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-11-4-6-12(7-5-11)13-10-14(15)18(16-13)9-8-17(2)3/h4-7,10H,8-9,15H2,1-3H3.
What are the key properties of 1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine?
1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine has a molecular weight of 244.34 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)pyrazol-5-amine is sourced from PubChem (CID 62687876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).