N-(2-phenoxyethyl)-N-propylpiperidin-4-amine

C16H26N2O — CID 60807688

IUPACN-(2-phenoxyethyl)-N-propylpiperidin-4-amine
SMILESCCCN(CCOc1ccccc1)C1CCNCC1
InChIInChI=1S/C16H26N2O/c1-2-12-18(15-8-10-17-11-9-15)13-14-19-16-6-4-3-5-7-16/h3-7,15,17H,2,8-14H2,1H3
InChIKeyWNMSRJAKLLXZOM-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.53
Rot. Bonds7

About N-(2-phenoxyethyl)-N-propylpiperidin-4-amine

N-(2-phenoxyethyl)-N-propylpiperidin-4-amine (PubChem CID 60807688) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-(2-phenoxyethyl)-N-propylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2-phenoxyethyl)-N-propylpiperidin-4-amine
PubChem CID60807688
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-(2-phenoxyethyl)-N-propylpiperidin-4-amine
SMILESCCCN(CCOc1ccccc1)C1CCNCC1
InChIInChI=1S/C16H26N2O/c1-2-12-18(15-8-10-17-11-9-15)13-14-19-16-6-4-3-5-7-16/h3-7,15,17H,2,8-14H2,1H3
InChIKeyWNMSRJAKLLXZOM-UHFFFAOYSA-N
XLogP2.53
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-phenoxyethyl)-N-propylpiperidin-4-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-[2-(4-fluorophenoxy)ethyl]-N-propylpiperidin-4-amine;hydrochloride
CID 119932771
N-[2-(2-methoxyphenoxy)ethyl]-N-propylpiperidin-4-amine;hydrochloride
CID 119933164
N-[3-(3-methylphenoxy)propyl]-N-propylpiperidin-4-amine
CID 60806318
N-[2-(2,5-dimethylphenoxy)ethyl]-N-propylpiperidin-4-amine
CID 60807508
N-[2-(4-bromophenoxy)ethyl]-N-propylcyclopropanamine
CID 54971490
N-(2-phenoxyethyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide
CID 119921645
N-[2-(2-chlorophenoxy)ethyl]-N-propylpyrrolidin-3-amine;hydrochloride
CID 119921660
N-piperidin-4-yl-4-propoxy-N-propylbenzenesulfonamide
CID 119993786
N-[2-[3-(aminomethyl)phenoxy]ethyl]-N-propylcyclopropanamine
CID 43270084
N-[2-(3-methylphenoxy)ethyl]-N-propylazetidin-3-amine
CID 66214496
1-phenyl-2-[piperidin-4-yl(propyl)amino]ethanone
CID 62031069
N-[(3-propoxyphenyl)methyl]-N-propylpyrrolidin-3-amine
CID 63300619

Frequently Asked Questions

What is the IUPAC name of N-(2-phenoxyethyl)-N-propylpiperidin-4-amine?
The IUPAC name of N-(2-phenoxyethyl)-N-propylpiperidin-4-amine (CID 60807688) is N-(2-phenoxyethyl)-N-propylpiperidin-4-amine.
What is the SMILES notation for N-(2-phenoxyethyl)-N-propylpiperidin-4-amine?
The canonical SMILES for N-(2-phenoxyethyl)-N-propylpiperidin-4-amine is CCCN(CCOc1ccccc1)C1CCNCC1.
What is the InChIKey of N-(2-phenoxyethyl)-N-propylpiperidin-4-amine?
The InChIKey is WNMSRJAKLLXZOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-2-12-18(15-8-10-17-11-9-15)13-14-19-16-6-4-3-5-7-16/h3-7,15,17H,2,8-14H2,1H3.
What are the key properties of N-(2-phenoxyethyl)-N-propylpiperidin-4-amine?
N-(2-phenoxyethyl)-N-propylpiperidin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 2.53, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenoxyethyl)-N-propylpiperidin-4-amine is sourced from PubChem (CID 60807688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).