5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine

C17H23N3 — CID 80634444

IUPAC5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine
SMILESCc1ccccc1N(C)c1ncc(CC(C)N)cc1C
InChIInChI=1S/C17H23N3/c1-12-7-5-6-8-16(12)20(4)17-13(2)9-15(11-19-17)10-14(3)18/h5-9,11,14H,10,18H2,1-4H3
InChIKeyPVRCOYJRTFWIJK-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.36
Rot. Bonds4

About 5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine

5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine (PubChem CID 80634444) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine.

Molecular Properties

Compound Name5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine
PubChem CID80634444
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine
SMILESCc1ccccc1N(C)c1ncc(CC(C)N)cc1C
InChIInChI=1S/C17H23N3/c1-12-7-5-6-8-16(12)20(4)17-13(2)9-15(11-19-17)10-14(3)18/h5-9,11,14H,10,18H2,1-4H3
InChIKeyPVRCOYJRTFWIJK-UHFFFAOYSA-N
XLogP3.36
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-aminobutyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine
CID 80630732
5-(2-aminopropyl)-N-[(2-chlorophenyl)methyl]-N,3-dimethylpyridin-2-amine
CID 80630036
5-(2-aminopropyl)-N-(1-methoxypropan-2-yl)-N,3-dimethylpyridin-2-amine
CID 80635092
4-(2-aminopropyl)-N-ethyl-2-methyl-N-(2-methylphenyl)aniline
CID 63785927
5-(2-aminopropyl)-N,3-dimethyl-N-pentylpyridin-2-amine
CID 80633736
5-(2-aminopropyl)-N,3-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine
CID 80633813
5-(2-aminopropyl)-N-(furan-3-ylmethyl)-N,3-dimethylpyridin-2-amine
CID 80634374
5-(2-aminoethyl)-N-(2-methoxyphenyl)-N,3-dimethylpyridin-2-amine
CID 80634800
5-(2-aminopropyl)-N-(cyclopentylmethyl)-N,3-dimethylpyridin-2-amine
CID 80634568
5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine
CID 80633214
5-(2-aminopropyl)-3-methyl-N-(2-methylpropyl)-N-pentan-3-ylpyridin-2-amine
CID 80630712
5-(aminomethyl)-N,3-dimethyl-N-phenylpyridin-2-amine
CID 79884611

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine?
The IUPAC name of 5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine (CID 80634444) is 5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine.
What is the SMILES notation for 5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine?
The canonical SMILES for 5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine is Cc1ccccc1N(C)c1ncc(CC(C)N)cc1C.
What is the InChIKey of 5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine?
The InChIKey is PVRCOYJRTFWIJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-12-7-5-6-8-16(12)20(4)17-13(2)9-15(11-19-17)10-14(3)18/h5-9,11,14H,10,18H2,1-4H3.
What are the key properties of 5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine?
5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine has a molecular weight of 269.39 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine is sourced from PubChem (CID 80634444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).