5-tert-butylpyrazolidin-3-amine;hydrochloride

C7H18ClN3 — CID 170905663

IUPAC5-tert-butylpyrazolidin-3-amine;hydrochloride
SMILESCC(C)(C)C1CC(N)NN1.Cl
InChIInChI=1S/C7H17N3.ClH/c1-7(2,3)5-4-6(8)10-9-5;/h5-6,9-10H,4,8H2,1-3H3;1H
InChIKeyVWKQDHHKKACOGJ-UHFFFAOYSA-N
MW179.69 g/mol
LogP0.61
Rot. Bonds

About 5-tert-butylpyrazolidin-3-amine;hydrochloride

5-tert-butylpyrazolidin-3-amine;hydrochloride (PubChem CID 170905663) has the molecular formula C7H18ClN3 and a molecular weight of 179.69 g/mol. Its IUPAC name is 5-tert-butylpyrazolidin-3-amine;hydrochloride.

Molecular Properties

Compound Name5-tert-butylpyrazolidin-3-amine;hydrochloride
PubChem CID170905663
Molecular FormulaC7H18ClN3
Molecular Weight179.69 g/mol
Exact Mass179.12
IUPAC Name5-tert-butylpyrazolidin-3-amine;hydrochloride
SMILESCC(C)(C)C1CC(N)NN1.Cl
InChIInChI=1S/C7H17N3.ClH/c1-7(2,3)5-4-6(8)10-9-5;/h5-6,9-10H,4,8H2,1-3H3;1H
InChIKeyVWKQDHHKKACOGJ-UHFFFAOYSA-N
XLogP0.61
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.69
LogP ≤ 50.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 5-tert-butylpyrazolidin-3-amine;hydrochloride 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

5-tert-butylpyrazolidine-3-carbonitrile
CID 140634582
trans-(1R,2S)-2-tert-butylcyclopropan-1-amine;hydrochloride
CID 139022348
3,5-bis(3-methylpentan-3-yl)pyrazolidine
CID 140634581
(5-tert-butylpyrrolidin-3-yl)-methylphosphane
CID 146297937
5-tert-butyl-2-methylmorpholine
CID 82280213
(5-tert-butylpyrrolidin-2-yl)methanol
CID 73079870
2-tert-butyl-4-(trifluoromethyl)pyrrolidine
CID 82606198
6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 133264661
cis-(1S,2R)-2-methylcyclopropan-1-amine;hydrochloride
CID 146012745
(3aS,5S,6aS)-2,5-ditert-butyl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrole
CID 161153492
3-tert-butylmorpholine;methanamine
CID 144581691
3-tert-butyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline
CID 154601200

Frequently Asked Questions

What is the IUPAC name of 5-tert-butylpyrazolidin-3-amine;hydrochloride?
The IUPAC name of 5-tert-butylpyrazolidin-3-amine;hydrochloride (CID 170905663) is 5-tert-butylpyrazolidin-3-amine;hydrochloride.
What is the SMILES notation for 5-tert-butylpyrazolidin-3-amine;hydrochloride?
The canonical SMILES for 5-tert-butylpyrazolidin-3-amine;hydrochloride is CC(C)(C)C1CC(N)NN1.Cl.
What is the InChIKey of 5-tert-butylpyrazolidin-3-amine;hydrochloride?
The InChIKey is VWKQDHHKKACOGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3.ClH/c1-7(2,3)5-4-6(8)10-9-5;/h5-6,9-10H,4,8H2,1-3H3;1H.
What are the key properties of 5-tert-butylpyrazolidin-3-amine;hydrochloride?
5-tert-butylpyrazolidin-3-amine;hydrochloride has a molecular weight of 179.69 g/mol, XLogP of 0.61, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butylpyrazolidin-3-amine;hydrochloride is sourced from PubChem (CID 170905663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).