1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine

C16H25N3 — CID 81466711

IUPAC1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine
SMILESCC1CC(Nc2ccccc2N2CCCC2)CN1C
InChIInChI=1S/C16H25N3/c1-13-11-14(12-18(13)2)17-15-7-3-4-8-16(15)19-9-5-6-10-19/h3-4,7-8,13-14,17H,5-6,9-12H2,1-2H3
InChIKeyAAZGQRHVTQHUAC-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.79
Rot. Bonds3

About 1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine

1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine (PubChem CID 81466711) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is 1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine
PubChem CID81466711
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine
SMILESCC1CC(Nc2ccccc2N2CCCC2)CN1C
InChIInChI=1S/C16H25N3/c1-13-11-14(12-18(13)2)17-15-7-3-4-8-16(15)19-9-5-6-10-19/h3-4,7-8,13-14,17H,5-6,9-12H2,1-2H3
InChIKeyAAZGQRHVTQHUAC-UHFFFAOYSA-N
XLogP2.79
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]ethanol
CID 81466936
N-(3-bromo-2-methylphenyl)-1,5-dimethylpyrrolidin-3-amine
CID 115928714
N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine
CID 81468176
4-N-(2-piperidin-1-ylphenyl)cyclohexane-1,4-diamine
CID 79724003
N-(2-pyrrolidin-1-ylphenyl)-1-azabicyclo[2.2.2]octan-3-amine
CID 43684279
N-(5-bromo-2,4-difluorophenyl)-1,5-dimethylpyrrolidin-3-amine
CID 102852892
1,1-dioxo-N-(2-piperidin-1-ylphenyl)thian-4-amine
CID 43511595
4-ethyl-N-(2-pyrrolidin-1-ylphenyl)cycloheptan-1-amine
CID 65084436
N-(1,5-dimethylpyrrolidin-3-yl)isoquinolin-8-amine
CID 81467572
N-(2-piperidin-1-ylphenyl)azepan-4-amine
CID 103980647
2,2,5,5-tetramethyl-N-(2-pyrrolidin-1-ylphenyl)oxolan-3-amine
CID 79907754
N-methyl-2-pyrrolidin-1-ylaniline;hydrochloride
CID 174970195

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine?
The IUPAC name of 1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine (CID 81466711) is 1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine.
What is the SMILES notation for 1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine?
The canonical SMILES for 1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine is CC1CC(Nc2ccccc2N2CCCC2)CN1C.
What is the InChIKey of 1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine?
The InChIKey is AAZGQRHVTQHUAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-13-11-14(12-18(13)2)17-15-7-3-4-8-16(15)19-9-5-6-10-19/h3-4,7-8,13-14,17H,5-6,9-12H2,1-2H3.
What are the key properties of 1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine?
1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine has a molecular weight of 259.40 g/mol, XLogP of 2.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine is sourced from PubChem (CID 81466711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).