N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine

C14H22N2O — CID 79730821

IUPACN-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine
SMILESCCC(NC1CCNC1)c1ccc(OC)cc1
InChIInChI=1S/C14H22N2O/c1-3-14(16-12-8-9-15-10-12)11-4-6-13(17-2)7-5-11/h4-7,12,14-16H,3,8-10H2,1-2H3
InChIKeyLEBMROIMFQNLAZ-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.10
Rot. Bonds5

About N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine

N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine (PubChem CID 79730821) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine
PubChem CID79730821
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine
SMILESCCC(NC1CCNC1)c1ccc(OC)cc1
InChIInChI=1S/C14H22N2O/c1-3-14(16-12-8-9-15-10-12)11-4-6-13(17-2)7-5-11/h4-7,12,14-16H,3,8-10H2,1-2H3
InChIKeyLEBMROIMFQNLAZ-UHFFFAOYSA-N
XLogP2.10
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(4-methoxyphenyl)propyl]pyrrolidin-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

N-[1-(4-methoxyphenyl)ethyl]pyrrolidin-3-amine
CID 79741892
N-[1-(4-methoxyphenyl)propyl]-1-propylpiperidin-4-amine
CID 43183002
3-methoxy-N-[1-(4-methoxyphenyl)propyl]cyclohexan-1-amine
CID 103904067
N-[(1S)-1-(4-methoxyphenyl)ethyl]piperidin-3-amine
CID 81370566
N-[bis(4-methoxyphenyl)methyl]piperidin-4-amine
CID 22111110
N-[1-(4-methoxyphenyl)propyl]oxan-3-amine
CID 63359865
N-[1-(4-methoxyphenyl)propyl]-1-prop-2-ynylpiperidin-4-amine
CID 43785961
1-(4-methoxyphenyl)-N-methyl-2-pyrrolidin-3-ylethanamine
CID 116951547
N-[1-(4-methoxyphenyl)propyl]piperidine-3-carboxamide
CID 43708609
N-cyclobutyl-1-(4-methoxyphenyl)ethane-1,2-diamine
CID 105476319
N-[1-(4-methoxyphenyl)propyl]-2-methylcyclohexan-1-amine
CID 43080624
N-[1-(4-methoxyphenyl)propyl]-2-piperidin-4-ylacetamide
CID 61029711

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine?
The IUPAC name of N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine (CID 79730821) is N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine.
What is the SMILES notation for N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine?
The canonical SMILES for N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine is CCC(NC1CCNC1)c1ccc(OC)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine?
The InChIKey is LEBMROIMFQNLAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-3-14(16-12-8-9-15-10-12)11-4-6-13(17-2)7-5-11/h4-7,12,14-16H,3,8-10H2,1-2H3.
What are the key properties of N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine?
N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine has a molecular weight of 234.34 g/mol, XLogP of 2.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine is sourced from PubChem (CID 79730821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).