3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine

C11H17ClN2O2 — CID 84586634

IUPAC3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine
SMILESCOCCN(CCOC)c1ncccc1Cl
InChIInChI=1S/C11H17ClN2O2/c1-15-8-6-14(7-9-16-2)11-10(12)4-3-5-13-11/h3-5H,6-9H2,1-2H3
InChIKeyHGXVOSMIUYHWGI-UHFFFAOYSA-N
MW244.72 g/mol
LogP1.83
Rot. Bonds7

About 3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine

3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine (PubChem CID 84586634) has the molecular formula C11H17ClN2O2 and a molecular weight of 244.72 g/mol. Its IUPAC name is 3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine.

Molecular Properties

Compound Name3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine
PubChem CID84586634
Molecular FormulaC11H17ClN2O2
Molecular Weight244.72 g/mol
Exact Mass244.10
IUPAC Name3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine
SMILESCOCCN(CCOC)c1ncccc1Cl
InChIInChI=1S/C11H17ClN2O2/c1-15-8-6-14(7-9-16-2)11-10(12)4-3-5-13-11/h3-5H,6-9H2,1-2H3
InChIKeyHGXVOSMIUYHWGI-UHFFFAOYSA-N
XLogP1.83
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.72
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine?
The IUPAC name of 3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine (CID 84586634) is 3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine.
What is the SMILES notation for 3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine?
The canonical SMILES for 3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine is COCCN(CCOC)c1ncccc1Cl.
What is the InChIKey of 3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine?
The InChIKey is HGXVOSMIUYHWGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2O2/c1-15-8-6-14(7-9-16-2)11-10(12)4-3-5-13-11/h3-5H,6-9H2,1-2H3.
What are the key properties of 3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine?
3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine has a molecular weight of 244.72 g/mol, XLogP of 1.83, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N,N-bis(2-methoxyethyl)pyridin-2-amine is sourced from PubChem (CID 84586634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).