3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine

C16H27N3 — CID 61176873

IUPAC3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine
SMILESCCN(c1nc(C)cc(C)c1CN)C1CCCCC1
InChIInChI=1S/C16H27N3/c1-4-19(14-8-6-5-7-9-14)16-15(11-17)12(2)10-13(3)18-16/h10,14H,4-9,11,17H2,1-3H3
InChIKeyAHPKJNYJDWIHCZ-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.32
Rot. Bonds4

About 3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine

3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine (PubChem CID 61176873) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine
PubChem CID61176873
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC Name3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine
SMILESCCN(c1nc(C)cc(C)c1CN)C1CCCCC1
InChIInChI=1S/C16H27N3/c1-4-19(14-8-6-5-7-9-14)16-15(11-17)12(2)10-13(3)18-16/h10,14H,4-9,11,17H2,1-3H3
InChIKeyAHPKJNYJDWIHCZ-UHFFFAOYSA-N
XLogP3.32
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine?
The IUPAC name of 3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine (CID 61176873) is 3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine?
The canonical SMILES for 3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine is CCN(c1nc(C)cc(C)c1CN)C1CCCCC1.
What is the InChIKey of 3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine?
The InChIKey is AHPKJNYJDWIHCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-4-19(14-8-6-5-7-9-14)16-15(11-17)12(2)10-13(3)18-16/h10,14H,4-9,11,17H2,1-3H3.
What are the key properties of 3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine?
3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine has a molecular weight of 261.41 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-cyclohexyl-N-ethyl-4,6-dimethylpyridin-2-amine is sourced from PubChem (CID 61176873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).