5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine

C12H19ClN2O2 — CID 66233200

IUPAC5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine
SMILESCOCCCN(CCOC)c1ccc(Cl)cn1
InChIInChI=1S/C12H19ClN2O2/c1-16-8-3-6-15(7-9-17-2)12-5-4-11(13)10-14-12/h4-5,10H,3,6-9H2,1-2H3
InChIKeyBEGBYMMRQIYVHM-UHFFFAOYSA-N
MW258.75 g/mol
LogP2.22
Rot. Bonds8

About 5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine

5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine (PubChem CID 66233200) has the molecular formula C12H19ClN2O2 and a molecular weight of 258.75 g/mol. Its IUPAC name is 5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine
PubChem CID66233200
Molecular FormulaC12H19ClN2O2
Molecular Weight258.75 g/mol
Exact Mass258.11
IUPAC Name5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine
SMILESCOCCCN(CCOC)c1ccc(Cl)cn1
InChIInChI=1S/C12H19ClN2O2/c1-16-8-3-6-15(7-9-17-2)12-5-4-11(13)10-14-12/h4-5,10H,3,6-9H2,1-2H3
InChIKeyBEGBYMMRQIYVHM-UHFFFAOYSA-N
XLogP2.22
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.75
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-(2-aminoethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine
CID 80634663
6-[2-methoxyethyl(3-methoxypropyl)amino]pyridine-3-carboxylic acid
CID 55137664
6-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine
CID 54989774
6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine
CID 62284666
5-(ethylaminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyrazin-2-amine
CID 107379629
5-(chloromethyl)-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridin-2-amine
CID 54987100
N,5-diethyl-N-(2-methoxyethyl)pyridin-2-amine
CID 170641269
5-(ethylaminomethyl)-N,N-bis(2-methoxyethyl)pyridin-2-amine
CID 62287077
[2-[2-methoxyethyl(3-methoxypropyl)amino]-4-pyridinyl]methanol
CID 54989948
6-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)-2-propan-2-ylpyrimidin-4-amine
CID 80953158
N'-(2-methoxyethyl)-N'-pyrazin-2-ylpropane-1,3-diamine
CID 63287295
2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-6-N-methylpyrazine-2,6-diamine
CID 80806190

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine?
The IUPAC name of 5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine (CID 66233200) is 5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine?
The canonical SMILES for 5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine is COCCCN(CCOC)c1ccc(Cl)cn1.
What is the InChIKey of 5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine?
The InChIKey is BEGBYMMRQIYVHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19ClN2O2/c1-16-8-3-6-15(7-9-17-2)12-5-4-11(13)10-14-12/h4-5,10H,3,6-9H2,1-2H3.
What are the key properties of 5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine?
5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine has a molecular weight of 258.75 g/mol, XLogP of 2.22, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine is sourced from PubChem (CID 66233200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).