4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine

C14H28N2 — CID 106638181

IUPAC4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
SMILESCCCC1CCC(NCC2CCCN2)CC1
InChIInChI=1S/C14H28N2/c1-2-4-12-6-8-13(9-7-12)16-11-14-5-3-10-15-14/h12-16H,2-11H2,1H3
InChIKeyZUKLEDIDPKAIDB-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.69
Rot. Bonds5

About 4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine

4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine (PubChem CID 106638181) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
PubChem CID106638181
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
SMILESCCCC1CCC(NCC2CCCN2)CC1
InChIInChI=1S/C14H28N2/c1-2-4-12-6-8-13(9-7-12)16-11-14-5-3-10-15-14/h12-16H,2-11H2,1H3
InChIKeyZUKLEDIDPKAIDB-UHFFFAOYSA-N
XLogP2.69
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-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

N-(1-piperidin-2-ylpropan-2-yl)-4-propylcyclohexan-1-amine
CID 79538652
N-(piperidin-2-ylmethyl)cyclooctanamine
CID 106632850
1-butyl-N-(pyrrolidin-2-ylmethyl)piperidin-4-amine
CID 106637748
ethane;(2R)-2-propylpyrrolidine
CID 155717204
ethane;2-propylpyrrolidine
CID 143349498
N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine
CID 107417481
2-(2-cyclopropylethyl)pyrrolidine
CID 23166213
N-[(3-propylcyclobutyl)methyl]cyclopentanamine
CID 97034535
N-methyl-1-pyrrolidin-2-ylmethanamine;molecular hydrogen
CID 153348528
3-(pyrrolidin-2-ylmethylamino)cyclobutan-1-ol
CID 106638717
N-(4-propylcyclohexyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119304208
1-methyl-N-(piperidin-2-ylmethyl)piperidin-4-amine
CID 106633123

Frequently Asked Questions

What is the IUPAC name of 4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine?
The IUPAC name of 4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine (CID 106638181) is 4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for 4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine is CCCC1CCC(NCC2CCCN2)CC1.
What is the InChIKey of 4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine?
The InChIKey is ZUKLEDIDPKAIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-2-4-12-6-8-13(9-7-12)16-11-14-5-3-10-15-14/h12-16H,2-11H2,1H3.
What are the key properties of 4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine?
4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine has a molecular weight of 224.39 g/mol, XLogP of 2.69, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 106638181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).