5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine

C15H25N3 — CID 80633648

IUPAC5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine
SMILESCCN(c1ccc(CCN)cn1)C1CCCCC1
InChIInChI=1S/C15H25N3/c1-2-18(14-6-4-3-5-7-14)15-9-8-13(10-11-16)12-17-15/h8-9,12,14H,2-7,10-11,16H2,1H3
InChIKeyJPNHKXDVMQFUCQ-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.74
Rot. Bonds5

About 5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine

5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine (PubChem CID 80633648) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine
PubChem CID80633648
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine
SMILESCCN(c1ccc(CCN)cn1)C1CCCCC1
InChIInChI=1S/C15H25N3/c1-2-18(14-6-4-3-5-7-14)15-9-8-13(10-11-16)12-17-15/h8-9,12,14H,2-7,10-11,16H2,1H3
InChIKeyJPNHKXDVMQFUCQ-UHFFFAOYSA-N
XLogP2.74
TPSA42.15 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 ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine?
The IUPAC name of 5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine (CID 80633648) is 5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine.
What is the SMILES notation for 5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine?
The canonical SMILES for 5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine is CCN(c1ccc(CCN)cn1)C1CCCCC1.
What is the InChIKey of 5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine?
The InChIKey is JPNHKXDVMQFUCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-2-18(14-6-4-3-5-7-14)15-9-8-13(10-11-16)12-17-15/h8-9,12,14H,2-7,10-11,16H2,1H3.
What are the key properties of 5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine?
5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine has a molecular weight of 247.39 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-N-cyclohexyl-N-ethylpyridin-2-amine is sourced from PubChem (CID 80633648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).