N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine

C14H22N2O — CID 81465704

IUPACN-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine
SMILESCCOc1ccccc1NC1CC(C)N(C)C1
InChIInChI=1S/C14H22N2O/c1-4-17-14-8-6-5-7-13(14)15-12-9-11(2)16(3)10-12/h5-8,11-12,15H,4,9-10H2,1-3H3
InChIKeyUCPOMUBUSNFKJY-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.59
Rot. Bonds4

About N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine

N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine (PubChem CID 81465704) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine
PubChem CID81465704
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine
SMILESCCOc1ccccc1NC1CC(C)N(C)C1
InChIInChI=1S/C14H22N2O/c1-4-17-14-8-6-5-7-13(14)15-12-9-11(2)16(3)10-12/h5-8,11-12,15H,4,9-10H2,1-3H3
InChIKeyUCPOMUBUSNFKJY-UHFFFAOYSA-N
XLogP2.59
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(difluoromethoxy)phenyl]-1,5-dimethylpyrrolidin-3-amine
CID 81465818
1-[2-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]ethanol
CID 81466936
(2R,4S)-1,2-dimethyl-N-[2-(2,2,2-trifluoroethoxy)phenyl]piperidin-4-amine
CID 129381116
N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine
CID 81468176
1-N-(2-ethoxyphenyl)cyclohexane-1,3-diamine
CID 79459001
1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine
CID 81466711
N-(2,4-dimethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine
CID 81467101
N-(3-bromo-2-methylphenyl)-1,5-dimethylpyrrolidin-3-amine
CID 115928714
N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43730175
N-(2-ethoxyphenyl)thiolan-3-amine
CID 43191691
N-(1,5-dimethylpyrrolidin-3-yl)isoquinolin-8-amine
CID 81467572
ethyl 4-(2-ethoxyanilino)piperidine-1-carboxylate
CID 43758190

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine?
The IUPAC name of N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine (CID 81465704) is N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine.
What is the SMILES notation for N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine?
The canonical SMILES for N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine is CCOc1ccccc1NC1CC(C)N(C)C1.
What is the InChIKey of N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine?
The InChIKey is UCPOMUBUSNFKJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-4-17-14-8-6-5-7-13(14)15-12-9-11(2)16(3)10-12/h5-8,11-12,15H,4,9-10H2,1-3H3.
What are the key properties of N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine?
N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine has a molecular weight of 234.34 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 81465704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).