N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine

C13H20N2 — CID 78989080

IUPACN-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine
SMILESCc1ccc(N(C)C2CCNC2)c(C)c1
InChIInChI=1S/C13H20N2/c1-10-4-5-13(11(2)8-10)15(3)12-6-7-14-9-12/h4-5,8,12,14H,6-7,9H2,1-3H3
InChIKeyCVJFFXWZJGAYTM-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.10
Rot. Bonds2

About N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine

N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine (PubChem CID 78989080) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine
PubChem CID78989080
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine
SMILESCc1ccc(N(C)C2CCNC2)c(C)c1
InChIInChI=1S/C13H20N2/c1-10-4-5-13(11(2)8-10)15(3)12-6-7-14-9-12/h4-5,8,12,14H,6-7,9H2,1-3H3
InChIKeyCVJFFXWZJGAYTM-UHFFFAOYSA-N
XLogP2.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-tert-butyl-2-methylphenyl)-N-methylpyrrolidin-3-amine
CID 115118753
N-methyl-N-(2-methyl-5-propan-2-ylphenyl)pyrrolidin-3-amine
CID 115118743
N,4-dimethyl-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine;hydrochloride
CID 71640984
N-methyl-N-(2-methyl-5-nitrophenyl)pyrrolidin-3-amine
CID 63301746
N-(4,5-dimethyl-2-nitrophenyl)-N-methylpyrrolidin-3-amine
CID 114281474
N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-4-amine
CID 83713467
N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine
CID 63642105
N-methyl-N-(2,4,5-trimethylphenyl)azetidin-3-amine
CID 117040590
N-methyl-5-(3-methylphenyl)-N-pyrrolidin-3-ylpyrimidin-2-amine
CID 116977522
N-methyl-N-(2-methyl-4-nitrophenyl)azepan-4-amine
CID 107173916
N-methyl-N-(4-methyl-3-nitrophenyl)pyrrolidin-3-amine
CID 63301254
2-methyl-4-[methyl(pyrrolidin-3-yl)amino]benzamide
CID 81279435

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine?
The IUPAC name of N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine (CID 78989080) is N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine.
What is the SMILES notation for N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine?
The canonical SMILES for N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine is Cc1ccc(N(C)C2CCNC2)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine?
The InChIKey is CVJFFXWZJGAYTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-10-4-5-13(11(2)8-10)15(3)12-6-7-14-9-12/h4-5,8,12,14H,6-7,9H2,1-3H3.
What are the key properties of N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine?
N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine has a molecular weight of 204.32 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine is sourced from PubChem (CID 78989080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).