N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine

C17H22N2 — CID 91040072

IUPACN,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine
SMILESCc1cc(-c2cccnc2)ccc1C(C)(C)N(C)C
InChIInChI=1S/C17H22N2/c1-13-11-14(15-7-6-10-18-12-15)8-9-16(13)17(2,3)19(4)5/h6-12H,1-5H3
InChIKeyQWJMCBQSPRCKSR-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.85
Rot. Bonds3

About N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine

N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine (PubChem CID 91040072) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine
PubChem CID91040072
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC NameN,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine
SMILESCc1cc(-c2cccnc2)ccc1C(C)(C)N(C)C
InChIInChI=1S/C17H22N2/c1-13-11-14(15-7-6-10-18-12-15)8-9-16(13)17(2,3)19(4)5/h6-12H,1-5H3
InChIKeyQWJMCBQSPRCKSR-UHFFFAOYSA-N
XLogP3.85
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine?
The IUPAC name of N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine (CID 91040072) is N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine.
What is the SMILES notation for N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine?
The canonical SMILES for N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine is Cc1cc(-c2cccnc2)ccc1C(C)(C)N(C)C.
What is the InChIKey of N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine?
The InChIKey is QWJMCBQSPRCKSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-13-11-14(15-7-6-10-18-12-15)8-9-16(13)17(2,3)19(4)5/h6-12H,1-5H3.
What are the key properties of N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine?
N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine has a molecular weight of 254.38 g/mol, XLogP of 3.85, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2-methyl-4-pyridin-3-ylphenyl)propan-2-amine is sourced from PubChem (CID 91040072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).