4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine

C14H23ClN2O — CID 113380691

IUPAC4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine
SMILESCCCc1cc(CCl)cc(N(CC)CCOC)n1
InChIInChI=1S/C14H23ClN2O/c1-4-6-13-9-12(11-15)10-14(16-13)17(5-2)7-8-18-3/h9-10H,4-8,11H2,1-3H3
InChIKeyRREUKWVLDFAJFU-UHFFFAOYSA-N
MW270.80 g/mol
LogP3.25
Rot. Bonds8

About 4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine

4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine (PubChem CID 113380691) has the molecular formula C14H23ClN2O and a molecular weight of 270.80 g/mol. Its IUPAC name is 4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine.

Molecular Properties

Compound Name4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine
PubChem CID113380691
Molecular FormulaC14H23ClN2O
Molecular Weight270.80 g/mol
Exact Mass270.15
IUPAC Name4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine
SMILESCCCc1cc(CCl)cc(N(CC)CCOC)n1
InChIInChI=1S/C14H23ClN2O/c1-4-6-13-9-12(11-15)10-14(16-13)17(5-2)7-8-18-3/h9-10H,4-8,11H2,1-3H3
InChIKeyRREUKWVLDFAJFU-UHFFFAOYSA-N
XLogP3.25
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.80
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(chloromethyl)-N-(cyclopropylmethyl)-N,6-dipropylpyridin-2-amine
CID 113380688
4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine
CID 103340202
4-(chloromethyl)-N-methyl-N-pentyl-6-propylpyridin-2-amine
CID 113380652
N'-[4-(chloromethyl)-6-ethyl-2-pyridinyl]-N,N,N'-triethylpropane-1,3-diamine
CID 102996063
4-N,4-N-bis(2-methoxyethyl)-6-N-methyl-2-propylpyrimidine-4,6-diamine
CID 80955285
6-chloro-N-ethyl-N-(2-methoxyethyl)-2-propan-2-ylpyrimidin-4-amine
CID 80953498
6-N-ethyl-4-N,4-N-bis(2-methoxyethyl)-2-propylpyrimidine-4,6-diamine
CID 80941613
N,5-diethyl-N-(2-methoxyethyl)pyridin-2-amine
CID 170641269
4-(chloromethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-6-propylpyridin-2-amine
CID 105416214
2-chloro-N-(2-methoxyethyl)-N-methyl-6-propylpyridine-4-carboxamide
CID 113379836
4-(chloromethyl)-N-ethyl-2-fluoro-N-(2-methoxyethyl)aniline
CID 61446258
4-[(tert-butylamino)methyl]-N-ethyl-N-(2-methoxyethyl)pyridin-2-amine
CID 62293920

Frequently Asked Questions

What is the IUPAC name of 4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine?
The IUPAC name of 4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine (CID 113380691) is 4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine.
What is the SMILES notation for 4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine?
The canonical SMILES for 4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine is CCCc1cc(CCl)cc(N(CC)CCOC)n1.
What is the InChIKey of 4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine?
The InChIKey is RREUKWVLDFAJFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23ClN2O/c1-4-6-13-9-12(11-15)10-14(16-13)17(5-2)7-8-18-3/h9-10H,4-8,11H2,1-3H3.
What are the key properties of 4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine?
4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine has a molecular weight of 270.80 g/mol, XLogP of 3.25, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine is sourced from PubChem (CID 113380691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).