N-ethyl-1,2,3,4-tetrahydropyridin-2-amine

C7H14N2 — CID 18612367

IUPACN-ethyl-1,2,3,4-tetrahydropyridin-2-amine
SMILESCCNC1CCC=CN1
InChIInChI=1S/C7H14N2/c1-2-8-7-5-3-4-6-9-7/h4,6-9H,2-3,5H2,1H3
InChIKeyLSKAOLOCIWFHQI-UHFFFAOYSA-N
MW126.20 g/mol
LogP0.82
Rot. Bonds2

About N-ethyl-1,2,3,4-tetrahydropyridin-2-amine

N-ethyl-1,2,3,4-tetrahydropyridin-2-amine (PubChem CID 18612367) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is N-ethyl-1,2,3,4-tetrahydropyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-1,2,3,4-tetrahydropyridin-2-amine
PubChem CID18612367
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC NameN-ethyl-1,2,3,4-tetrahydropyridin-2-amine
SMILESCCNC1CCC=CN1
InChIInChI=1S/C7H14N2/c1-2-8-7-5-3-4-6-9-7/h4,6-9H,2-3,5H2,1H3
InChIKeyLSKAOLOCIWFHQI-UHFFFAOYSA-N
XLogP0.82
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1,2,3,4-tetrahydropyridin-2-amine?
The IUPAC name of N-ethyl-1,2,3,4-tetrahydropyridin-2-amine (CID 18612367) is N-ethyl-1,2,3,4-tetrahydropyridin-2-amine.
What is the SMILES notation for N-ethyl-1,2,3,4-tetrahydropyridin-2-amine?
The canonical SMILES for N-ethyl-1,2,3,4-tetrahydropyridin-2-amine is CCNC1CCC=CN1.
What is the InChIKey of N-ethyl-1,2,3,4-tetrahydropyridin-2-amine?
The InChIKey is LSKAOLOCIWFHQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-2-8-7-5-3-4-6-9-7/h4,6-9H,2-3,5H2,1H3.
What are the key properties of N-ethyl-1,2,3,4-tetrahydropyridin-2-amine?
N-ethyl-1,2,3,4-tetrahydropyridin-2-amine has a molecular weight of 126.20 g/mol, XLogP of 0.82, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1,2,3,4-tetrahydropyridin-2-amine is sourced from PubChem (CID 18612367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).