1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine

C18H24N2 — CID 60818337

IUPAC1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine
SMILESCCCNC(Cc1ccccn1)Cc1ccccc1C
InChIInChI=1S/C18H24N2/c1-3-11-19-18(14-17-10-6-7-12-20-17)13-16-9-5-4-8-15(16)2/h4-10,12,18-19H,3,11,13-14H2,1-2H3
InChIKeyCTSYEUZEMFYDBZ-UHFFFAOYSA-N
MW268.40 g/mol
LogP3.54
Rot. Bonds7

About 1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine

1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine (PubChem CID 60818337) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine.

Molecular Properties

Compound Name1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine
PubChem CID60818337
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine
SMILESCCCNC(Cc1ccccn1)Cc1ccccc1C
InChIInChI=1S/C18H24N2/c1-3-11-19-18(14-17-10-6-7-12-20-17)13-16-9-5-4-8-15(16)2/h4-10,12,18-19H,3,11,13-14H2,1-2H3
InChIKeyCTSYEUZEMFYDBZ-UHFFFAOYSA-N
XLogP3.54
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methylsulfanyl-N-propyl-1-pyridin-2-ylbutan-2-amine
CID 105157999
4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine
CID 62600384
1-(2-fluorophenyl)-N-propyl-4-pyridin-2-ylbutan-2-amine
CID 105090087
N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 112642797
N-propyl-1-(1-propylimidazol-2-yl)-3-pyridin-2-ylpropan-2-amine
CID 79752625
1-(2-methylphenyl)-3-methylsulfonyl-N-propylpropan-2-amine
CID 62473098
3-methyl-N-propyl-1-pyridin-2-ylbutan-2-amine
CID 60820074
1-(2-methylphenyl)-N-propylhex-4-yn-2-amine
CID 62311593
N-[1-(3,4-dimethylphenyl)-2-pyridin-2-ylethyl]propan-1-amine
CID 62550641
1-(3-chloro-4-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine
CID 103039837
1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine
CID 60817944
1-(3-bromothiophen-2-yl)-3-(2-methylphenyl)-N-propylpropan-2-amine
CID 63417463

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine?
The IUPAC name of 1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine (CID 60818337) is 1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine.
What is the SMILES notation for 1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine?
The canonical SMILES for 1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine is CCCNC(Cc1ccccn1)Cc1ccccc1C.
What is the InChIKey of 1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine?
The InChIKey is CTSYEUZEMFYDBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-3-11-19-18(14-17-10-6-7-12-20-17)13-16-9-5-4-8-15(16)2/h4-10,12,18-19H,3,11,13-14H2,1-2H3.
What are the key properties of 1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine?
1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine has a molecular weight of 268.40 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine is sourced from PubChem (CID 60818337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).