N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine

C15H25N3 — CID 62285464

IUPACN-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine
SMILESCCNCc1cccnc1N(C)C1CCCCC1
InChIInChI=1S/C15H25N3/c1-3-16-12-13-8-7-11-17-15(13)18(2)14-9-5-4-6-10-14/h7-8,11,14,16H,3-6,9-10,12H2,1-2H3
InChIKeyFVPYMCKCUDYDHL-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.96
Rot. Bonds5

About N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine

N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine (PubChem CID 62285464) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine
PubChem CID62285464
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine
SMILESCCNCc1cccnc1N(C)C1CCCCC1
InChIInChI=1S/C15H25N3/c1-3-16-12-13-8-7-11-17-15(13)18(2)14-9-5-4-6-10-14/h7-8,11,14,16H,3-6,9-10,12H2,1-2H3
InChIKeyFVPYMCKCUDYDHL-UHFFFAOYSA-N
XLogP2.96
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine?
The IUPAC name of N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine (CID 62285464) is N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine.
What is the SMILES notation for N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine?
The canonical SMILES for N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine is CCNCc1cccnc1N(C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine?
The InChIKey is FVPYMCKCUDYDHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-16-12-13-8-7-11-17-15(13)18(2)14-9-5-4-6-10-14/h7-8,11,14,16H,3-6,9-10,12H2,1-2H3.
What are the key properties of N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine?
N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine has a molecular weight of 247.39 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine is sourced from PubChem (CID 62285464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).