1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine

C10H23N3 — CID 130676072

IUPAC1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine
SMILESCC(N)CN1CCN[C@@H](C(C)C)C1
InChIInChI=1S/C10H23N3/c1-8(2)10-7-13(5-4-12-10)6-9(3)11/h8-10,12H,4-7,11H2,1-3H3/t9?,10-/m1/s1
InChIKeyACVPJQOOSAVAFS-QVDQXJPCSA-N
MW185.31 g/mol
LogP0.26
Rot. Bonds3

About 1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine

1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine (PubChem CID 130676072) has the molecular formula C10H23N3 and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine.

Molecular Properties

Compound Name1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine
PubChem CID130676072
Molecular FormulaC10H23N3
Molecular Weight185.31 g/mol
Exact Mass185.19
IUPAC Name1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine
SMILESCC(N)CN1CCN[C@@H](C(C)C)C1
InChIInChI=1S/C10H23N3/c1-8(2)10-7-13(5-4-12-10)6-9(3)11/h8-10,12H,4-7,11H2,1-3H3/t9?,10-/m1/s1
InChIKeyACVPJQOOSAVAFS-QVDQXJPCSA-N
XLogP0.26
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-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

Methyl(2-(4-methylpiperidin-1-yl)ethyl)amine
CID 43199381
2-(3,5-Dimethylpiperidin-1-yl)ethan-1-amine
CID 6484177
1-(2-Methylpropyl)piperazine
CID 2052052
2,3,5,6-Tetramethylpiperazine
CID 521970
1-(Cyclopropylmethyl)piperazine
CID 965875
3-Methyl-2-(piperazin-1-yl)butanenitrile
CID 16227099
1-Butylpiperazine
CID 424322
1-Cyclobutylpiperazine
CID 4738602
1-(4-Methylpiperazin-1-yl)propan-2-amine
CID 16643482
N-(2-Piperidylmethyl)-dimethylamine
CID 252484
1-(Butan-2-yl)piperazine
CID 2735696
1-(2-Diisopropylaminoethyl)piperazine
CID 2736173

Frequently Asked Questions

What is the IUPAC name of 1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine?
The IUPAC name of 1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine (CID 130676072) is 1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine.
What is the SMILES notation for 1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine?
The canonical SMILES for 1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine is CC(N)CN1CCN[C@@H](C(C)C)C1.
What is the InChIKey of 1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine?
The InChIKey is ACVPJQOOSAVAFS-QVDQXJPCSA-N. The full InChI is InChI=1S/C10H23N3/c1-8(2)10-7-13(5-4-12-10)6-9(3)11/h8-10,12H,4-7,11H2,1-3H3/t9?,10-/m1/s1.
What are the key properties of 1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine?
1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine has a molecular weight of 185.31 g/mol, XLogP of 0.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3S)-3-propan-2-ylpiperazin-1-yl]propan-2-amine is sourced from PubChem (CID 130676072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).