5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine

C16H21N3 — CID 80636098

IUPAC5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine
SMILESCc1cc(CN)cnc1N(C)CCc1ccccc1
InChIInChI=1S/C16H21N3/c1-13-10-15(11-17)12-18-16(13)19(2)9-8-14-6-4-3-5-7-14/h3-7,10,12H,8-9,11,17H2,1-2H3
InChIKeyPLUGCCSZXUYWJG-UHFFFAOYSA-N
MW255.37 g/mol
LogP2.53
Rot. Bonds5

About 5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine

5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine (PubChem CID 80636098) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is 5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine
PubChem CID80636098
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC Name5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine
SMILESCc1cc(CN)cnc1N(C)CCc1ccccc1
InChIInChI=1S/C16H21N3/c1-13-10-15(11-17)12-18-16(13)19(2)9-8-14-6-4-3-5-7-14/h3-7,10,12H,8-9,11,17H2,1-2H3
InChIKeyPLUGCCSZXUYWJG-UHFFFAOYSA-N
XLogP2.53
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(aminomethyl)-N,3-dimethyl-N-(2-pyridin-4-ylethyl)pyridin-2-amine
CID 80630342
5-(aminomethyl)-N,3-dimethyl-N-phenylpyridin-2-amine
CID 79884611
5-(aminomethyl)-N,3-dimethyl-N-[(2-methylphenyl)methyl]pyridin-2-amine
CID 80629685
3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine
CID 65484864
5-(aminomethyl)-N-[(2-chlorophenyl)methyl]-N,3-dimethylpyridin-2-amine
CID 80630348
N'-[5-(2-aminoethyl)-3-methyl-2-pyridinyl]-N,N,N'-trimethylethane-1,2-diamine
CID 80634571
2-[6-[benzyl(methyl)amino]-5-methyl-3-pyridinyl]ethanol
CID 102544765
N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine
CID 80629000
3-bromo-2-N,4-dimethyl-2-N-(2-phenylethyl)pyridine-2,5-diamine
CID 104506952
5-(2-aminoethyl)-N,3-dimethyl-N-phenylpyridin-2-amine
CID 80633206
5-bromo-N,3-dimethyl-N-[2-(4-methylphenyl)ethyl]pyridin-2-amine
CID 115148671
3-N-methyl-3-N-(2-phenylethyl)pyrazine-2,3-diamine
CID 113228940

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine?
The IUPAC name of 5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine (CID 80636098) is 5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine.
What is the SMILES notation for 5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine?
The canonical SMILES for 5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine is Cc1cc(CN)cnc1N(C)CCc1ccccc1.
What is the InChIKey of 5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine?
The InChIKey is PLUGCCSZXUYWJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-13-10-15(11-17)12-18-16(13)19(2)9-8-14-6-4-3-5-7-14/h3-7,10,12H,8-9,11,17H2,1-2H3.
What are the key properties of 5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine?
5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine has a molecular weight of 255.37 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine is sourced from PubChem (CID 80636098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).