5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine

C14H23N3 — CID 155167486

IUPAC5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine
SMILESCC(NCC1CCCCC1)c1ccc(N)nc1
InChIInChI=1S/C14H23N3/c1-11(13-7-8-14(15)17-10-13)16-9-12-5-3-2-4-6-12/h7-8,10-12,16H,2-6,9H2,1H3,(H2,15,17)
InChIKeyMNWYQETYUHUVJT-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.89
Rot. Bonds4

About 5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine

5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine (PubChem CID 155167486) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine
PubChem CID155167486
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine
SMILESCC(NCC1CCCCC1)c1ccc(N)nc1
InChIInChI=1S/C14H23N3/c1-11(13-7-8-14(15)17-10-13)16-9-12-5-3-2-4-6-12/h7-8,10-12,16H,2-6,9H2,1H3,(H2,15,17)
InChIKeyMNWYQETYUHUVJT-UHFFFAOYSA-N
XLogP2.89
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine?
The IUPAC name of 5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine (CID 155167486) is 5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine.
What is the SMILES notation for 5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine?
The canonical SMILES for 5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine is CC(NCC1CCCCC1)c1ccc(N)nc1.
What is the InChIKey of 5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine?
The InChIKey is MNWYQETYUHUVJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-11(13-7-8-14(15)17-10-13)16-9-12-5-3-2-4-6-12/h7-8,10-12,16H,2-6,9H2,1H3,(H2,15,17).
What are the key properties of 5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine?
5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine has a molecular weight of 233.36 g/mol, XLogP of 2.89, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine is sourced from PubChem (CID 155167486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).