1-(1,5-diethylazepan-3-yl)pyrazol-4-amine

C13H24N4 — CID 139421017

IUPAC1-(1,5-diethylazepan-3-yl)pyrazol-4-amine
SMILESCCC1CCN(CC)CC(n2cc(N)cn2)C1
InChIInChI=1S/C13H24N4/c1-3-11-5-6-16(4-2)10-13(7-11)17-9-12(14)8-15-17/h8-9,11,13H,3-7,10,14H2,1-2H3
InChIKeyMZZMOHSNCUZOEZ-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.15
Rot. Bonds3

About 1-(1,5-diethylazepan-3-yl)pyrazol-4-amine

1-(1,5-diethylazepan-3-yl)pyrazol-4-amine (PubChem CID 139421017) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-(1,5-diethylazepan-3-yl)pyrazol-4-amine.

Molecular Properties

Compound Name1-(1,5-diethylazepan-3-yl)pyrazol-4-amine
PubChem CID139421017
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC Name1-(1,5-diethylazepan-3-yl)pyrazol-4-amine
SMILESCCC1CCN(CC)CC(n2cc(N)cn2)C1
InChIInChI=1S/C13H24N4/c1-3-11-5-6-16(4-2)10-13(7-11)17-9-12(14)8-15-17/h8-9,11,13H,3-7,10,14H2,1-2H3
InChIKeyMZZMOHSNCUZOEZ-UHFFFAOYSA-N
XLogP2.15
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(1,5-diethylazepan-3-yl)pyrazol-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine
CID 155280275
2-[1-(1-ethylpyrrolidin-3-yl)pyrazol-4-yl]acetic acid
CID 105480595
1-cyclopentylpyrazol-4-amine;hydrochloride
CID 74890000
1,3-diethylpyrrolidine;ethane
CID 145103245
1-cyclohexylpyrazol-4-amine;hydrochloride
CID 83814238
1-(3-methoxycyclopentyl)pyrazol-4-amine
CID 118365537
1-(1-methylsulfonylpiperidin-4-yl)pyrazol-4-amine
CID 125499170
4-(4-aminopyrazol-1-yl)cyclohexane-1-carbonitrile
CID 131469436
[1-(1-ethylpiperidin-4-yl)pyrazol-4-yl]methanethiol
CID 155403635
1-(4-aminopyrazol-1-yl)-3-(3-ethylpiperidin-1-yl)propan-2-ol
CID 43584180
2-[1-(1-ethylpiperidin-3-yl)pyrazol-4-yl]acetonitrile
CID 105473088
cis-(1S,3R)-3-(4-aminopyrazol-1-yl)cyclohexan-1-ol
CID 118466984

Frequently Asked Questions

What is the IUPAC name of 1-(1,5-diethylazepan-3-yl)pyrazol-4-amine?
The IUPAC name of 1-(1,5-diethylazepan-3-yl)pyrazol-4-amine (CID 139421017) is 1-(1,5-diethylazepan-3-yl)pyrazol-4-amine.
What is the SMILES notation for 1-(1,5-diethylazepan-3-yl)pyrazol-4-amine?
The canonical SMILES for 1-(1,5-diethylazepan-3-yl)pyrazol-4-amine is CCC1CCN(CC)CC(n2cc(N)cn2)C1.
What is the InChIKey of 1-(1,5-diethylazepan-3-yl)pyrazol-4-amine?
The InChIKey is MZZMOHSNCUZOEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-3-11-5-6-16(4-2)10-13(7-11)17-9-12(14)8-15-17/h8-9,11,13H,3-7,10,14H2,1-2H3.
What are the key properties of 1-(1,5-diethylazepan-3-yl)pyrazol-4-amine?
1-(1,5-diethylazepan-3-yl)pyrazol-4-amine has a molecular weight of 236.36 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,5-diethylazepan-3-yl)pyrazol-4-amine is sourced from PubChem (CID 139421017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).