1-(6-methyldodecan-6-yl)pyrazolidin-3-amine

C16H35N3 — CID 170309506

IUPAC1-(6-methyldodecan-6-yl)pyrazolidin-3-amine
SMILESCCCCCCC(C)(CCCCC)N1CCC(N)N1
InChIInChI=1S/C16H35N3/c1-4-6-8-10-13-16(3,12-9-7-5-2)19-14-11-15(17)18-19/h15,18H,4-14,17H2,1-3H3
InChIKeyCQQGMUPOVOJVHG-UHFFFAOYSA-N
MW269.48 g/mol
LogP3.79
Rot. Bonds10

About 1-(6-methyldodecan-6-yl)pyrazolidin-3-amine

1-(6-methyldodecan-6-yl)pyrazolidin-3-amine (PubChem CID 170309506) has the molecular formula C16H35N3 and a molecular weight of 269.48 g/mol. Its IUPAC name is 1-(6-methyldodecan-6-yl)pyrazolidin-3-amine.

Molecular Properties

Compound Name1-(6-methyldodecan-6-yl)pyrazolidin-3-amine
PubChem CID170309506
Molecular FormulaC16H35N3
Molecular Weight269.48 g/mol
Exact Mass269.28
IUPAC Name1-(6-methyldodecan-6-yl)pyrazolidin-3-amine
SMILESCCCCCCC(C)(CCCCC)N1CCC(N)N1
InChIInChI=1S/C16H35N3/c1-4-6-8-10-13-16(3,12-9-7-5-2)19-14-11-15(17)18-19/h15,18H,4-14,17H2,1-3H3
InChIKeyCQQGMUPOVOJVHG-UHFFFAOYSA-N
XLogP3.79
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.48
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(6-methyldodecan-6-yl)pyrazolidin-3-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-(6-methyldodecan-6-yl)pyrrolidin-2-amine
CID 170325114
2-(6-methyldodecan-6-yl)pyrazolidin-3-amine
CID 170307894
1-(6-methyldodecan-6-yl)azetidin-3-amine
CID 130337700
1-(7-methyltetradecan-7-yl)piperidin-3-amine
CID 126486331
4-methyl-1-(7-methyltridecan-7-yl)piperidin-3-amine
CID 130337153
1-(7-methyltetradecan-7-yl)-1,3-diazetidine
CID 139436879
3-(6-methylundecan-6-yl)imidazolidin-4-amine
CID 170307896
1-(7-methyltridecan-7-yl)pyrrolidine
CID 131990775
2-methyl-2-(4-propan-2-ylpiperidin-1-yl)nonan-1-amine
CID 103494824
2-(4-tert-butylpiperidin-1-yl)-2-methylnonan-1-amine
CID 63465793
1-(2-methylnonan-2-yl)pyrrolidin-3-amine
CID 130338700
4-(5-methyldodecan-5-yl)morpholine
CID 138551223

Frequently Asked Questions

What is the IUPAC name of 1-(6-methyldodecan-6-yl)pyrazolidin-3-amine?
The IUPAC name of 1-(6-methyldodecan-6-yl)pyrazolidin-3-amine (CID 170309506) is 1-(6-methyldodecan-6-yl)pyrazolidin-3-amine.
What is the SMILES notation for 1-(6-methyldodecan-6-yl)pyrazolidin-3-amine?
The canonical SMILES for 1-(6-methyldodecan-6-yl)pyrazolidin-3-amine is CCCCCCC(C)(CCCCC)N1CCC(N)N1.
What is the InChIKey of 1-(6-methyldodecan-6-yl)pyrazolidin-3-amine?
The InChIKey is CQQGMUPOVOJVHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N3/c1-4-6-8-10-13-16(3,12-9-7-5-2)19-14-11-15(17)18-19/h15,18H,4-14,17H2,1-3H3.
What are the key properties of 1-(6-methyldodecan-6-yl)pyrazolidin-3-amine?
1-(6-methyldodecan-6-yl)pyrazolidin-3-amine has a molecular weight of 269.48 g/mol, XLogP of 3.79, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methyldodecan-6-yl)pyrazolidin-3-amine is sourced from PubChem (CID 170309506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).