N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride

C10H17ClN2 — CID 16682376

IUPACN-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride
SMILESCCN(CC)Cc1ccccn1.Cl
InChIInChI=1S/C10H16N2.ClH/c1-3-12(4-2)9-10-7-5-6-8-11-10;/h5-8H,3-4,9H2,1-2H3;1H
InChIKeyXHSSIWVXAYZDDZ-UHFFFAOYSA-N
MW200.71 g/mol
LogP2.35
Rot. Bonds4

About N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride

N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride (PubChem CID 16682376) has the molecular formula C10H17ClN2 and a molecular weight of 200.71 g/mol. Its IUPAC name is N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride.

Molecular Properties

Compound NameN-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride
PubChem CID16682376
Molecular FormulaC10H17ClN2
Molecular Weight200.71 g/mol
Exact Mass200.11
IUPAC NameN-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride
SMILESCCN(CC)Cc1ccccn1.Cl
InChIInChI=1S/C10H16N2.ClH/c1-3-12(4-2)9-10-7-5-6-8-11-10;/h5-8H,3-4,9H2,1-2H3;1H
InChIKeyXHSSIWVXAYZDDZ-UHFFFAOYSA-N
XLogP2.35
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.71
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride?
The IUPAC name of N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride (CID 16682376) is N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride.
What is the SMILES notation for N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride?
The canonical SMILES for N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride is CCN(CC)Cc1ccccn1.Cl.
What is the InChIKey of N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride?
The InChIKey is XHSSIWVXAYZDDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2.ClH/c1-3-12(4-2)9-10-7-5-6-8-11-10;/h5-8H,3-4,9H2,1-2H3;1H.
What are the key properties of N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride?
N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride has a molecular weight of 200.71 g/mol, XLogP of 2.35, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(pyridin-2-ylmethyl)ethanamine;hydrochloride is sourced from PubChem (CID 16682376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).