N,1-diethylpyrazol-4-amine

C7H13N3 — CID 43543394

IUPACN,1-diethylpyrazol-4-amine
SMILESCCNc1cnn(CC)c1
InChIInChI=1S/C7H13N3/c1-3-8-7-5-9-10(4-2)6-7/h5-6,8H,3-4H2,1-2H3
InChIKeyUNGMQQGBHGRENQ-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.33
Rot. Bonds3

About N,1-diethylpyrazol-4-amine

N,1-diethylpyrazol-4-amine (PubChem CID 43543394) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is N,1-diethylpyrazol-4-amine.

Molecular Properties

Compound NameN,1-diethylpyrazol-4-amine
PubChem CID43543394
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC NameN,1-diethylpyrazol-4-amine
SMILESCCNc1cnn(CC)c1
InChIInChI=1S/C7H13N3/c1-3-8-7-5-9-10(4-2)6-7/h5-6,8H,3-4H2,1-2H3
InChIKeyUNGMQQGBHGRENQ-UHFFFAOYSA-N
XLogP1.33
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine
CID 43729152
1-ethyl-N-(2-methylpentyl)pyrazol-4-amine
CID 43543330
4-[[(1-ethylpyrazol-4-yl)amino]methyl]phenol
CID 19627559
1-ethyl-N-(2-phenylethyl)pyrazol-4-amine
CID 43543523
1-ethyl-3-(1-ethylpyrazol-4-yl)urea
CID 115581870
N-(3,3-dimethylbutan-2-yl)-1-ethylpyrazol-4-amine
CID 115922661
1-ethyl-N-[(2-ethylpyrazol-3-yl)methyl]pyrazol-4-amine
CID 19626405
1-ethyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-4-amine;hydrochloride
CID 126964986
N-cycloheptyl-1-ethylpyrazol-4-amine
CID 43543541
1-ethyl-N-[(2-ethylpyrazol-3-yl)methyl]pyrazol-4-amine;hydrochloride
CID 126965183
2-[4-[(1-ethylpyrazol-4-yl)methylamino]pyrazol-1-yl]ethanol
CID 122166813
(1-ethylpyrazol-4-yl)thiourea
CID 43543607

Frequently Asked Questions

What is the IUPAC name of N,1-diethylpyrazol-4-amine?
The IUPAC name of N,1-diethylpyrazol-4-amine (CID 43543394) is N,1-diethylpyrazol-4-amine.
What is the SMILES notation for N,1-diethylpyrazol-4-amine?
The canonical SMILES for N,1-diethylpyrazol-4-amine is CCNc1cnn(CC)c1.
What is the InChIKey of N,1-diethylpyrazol-4-amine?
The InChIKey is UNGMQQGBHGRENQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-3-8-7-5-9-10(4-2)6-7/h5-6,8H,3-4H2,1-2H3.
What are the key properties of N,1-diethylpyrazol-4-amine?
N,1-diethylpyrazol-4-amine has a molecular weight of 139.20 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-diethylpyrazol-4-amine is sourced from PubChem (CID 43543394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).