N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine

C15H32N2 — CID 103781482

IUPACN-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine
SMILESCCCCC(CCC)NC1CCN(C(C)C)C1
InChIInChI=1S/C15H32N2/c1-5-7-9-14(8-6-2)16-15-10-11-17(12-15)13(3)4/h13-16H,5-12H2,1-4H3
InChIKeyAKNLXVZBLAGYGD-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.42
Rot. Bonds8

About N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine

N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine (PubChem CID 103781482) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine
PubChem CID103781482
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine
SMILESCCCCC(CCC)NC1CCN(C(C)C)C1
InChIInChI=1S/C15H32N2/c1-5-7-9-14(8-6-2)16-15-10-11-17(12-15)13(3)4/h13-16H,5-12H2,1-4H3
InChIKeyAKNLXVZBLAGYGD-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-octan-4-yl-1-propan-2-ylpyrrolidin-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-methyl-N-octan-4-ylpiperidin-4-amine
CID 103776296
N-(1-methylsulfanylbutan-2-yl)-1-propan-2-ylpyrrolidin-3-amine
CID 115901796
1-methyl-N-octan-4-ylazepan-4-amine
CID 113340340
(3S)-N,1-di(propan-2-yl)pyrrolidin-3-amine
CID 94057880
N-heptan-4-yl-1-methylpiperidin-4-amine
CID 43373353
(3R)-N-methyl-1-propan-2-ylpyrrolidin-3-amine
CID 55299463
N-(1-methylsulfanylpropan-2-yl)-1-propan-2-ylpyrrolidin-3-amine
CID 115721705
N-octan-4-yl-4-propylcyclohexan-1-amine
CID 114138056
N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]hexan-2-amine
CID 61207933
N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine
CID 115717125
3-pentyl-1-propan-2-ylpyrrolidine
CID 145194112
2-methyl-3-[(1-propan-2-ylpyrrolidin-3-yl)amino]butan-1-ol
CID 115689458

Frequently Asked Questions

What is the IUPAC name of N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine?
The IUPAC name of N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine (CID 103781482) is N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine.
What is the SMILES notation for N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine?
The canonical SMILES for N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine is CCCCC(CCC)NC1CCN(C(C)C)C1.
What is the InChIKey of N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine?
The InChIKey is AKNLXVZBLAGYGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-5-7-9-14(8-6-2)16-15-10-11-17(12-15)13(3)4/h13-16H,5-12H2,1-4H3.
What are the key properties of N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine?
N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine has a molecular weight of 240.43 g/mol, XLogP of 3.42, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-octan-4-yl-1-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 103781482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).