4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine

C17H29N3O — CID 103340202

IUPAC4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine
SMILESC=CCN(CCOC)c1cc(CNCC)cc(CCC)n1
InChIInChI=1S/C17H29N3O/c1-5-8-16-12-15(14-18-7-3)13-17(19-16)20(9-6-2)10-11-21-4/h6,12-13,18H,2,5,7-11,14H2,1,3-4H3
InChIKeyBFVGLKXHENWDNZ-UHFFFAOYSA-N
MW291.44 g/mol
LogP2.78
Rot. Bonds11

About 4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine

4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine (PubChem CID 103340202) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is 4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine.

Molecular Properties

Compound Name4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine
PubChem CID103340202
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC Name4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine
SMILESC=CCN(CCOC)c1cc(CNCC)cc(CCC)n1
InChIInChI=1S/C17H29N3O/c1-5-8-16-12-15(14-18-7-3)13-17(19-16)20(9-6-2)10-11-21-4/h6,12-13,18H,2,5,7-11,14H2,1,3-4H3
InChIKeyBFVGLKXHENWDNZ-UHFFFAOYSA-N
XLogP2.78
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(ethylaminomethyl)-6-methyl-N-prop-2-enyl-N-propylpyridin-2-amine
CID 113379421
4-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)-6-propylpyridin-2-amine
CID 113380691
N-(2-methoxyethyl)-4-[(2-methylpropylamino)methyl]-N-prop-2-enylpyridin-2-amine
CID 103340117
N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine
CID 103340163
5-(ethylaminomethyl)-N,N-bis(2-methoxyethyl)pyridin-2-amine
CID 62287077
N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-prop-2-enylpyrazin-2-amine
CID 107381055
4-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-N-prop-2-enylpyridin-2-amine
CID 103339243
[2-[2-methoxyethyl(prop-2-enyl)amino]quinolin-4-yl]methanol
CID 103340021
4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridin-2-amine
CID 55059734
5-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enylpyridine-2-sulfonamide
CID 103340666
6-[(tert-butylamino)methyl]-5-chloro-N-(2-methoxyethyl)-N-prop-2-enylpyridin-2-amine
CID 103340062
6-(aminomethyl)-N-(2-methoxyethyl)-N-prop-2-enylpyridazin-3-amine
CID 103340205

Frequently Asked Questions

What is the IUPAC name of 4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine?
The IUPAC name of 4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine (CID 103340202) is 4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine.
What is the SMILES notation for 4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine?
The canonical SMILES for 4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine is C=CCN(CCOC)c1cc(CNCC)cc(CCC)n1.
What is the InChIKey of 4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine?
The InChIKey is BFVGLKXHENWDNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-5-8-16-12-15(14-18-7-3)13-17(19-16)20(9-6-2)10-11-21-4/h6,12-13,18H,2,5,7-11,14H2,1,3-4H3.
What are the key properties of 4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine?
4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine has a molecular weight of 291.44 g/mol, XLogP of 2.78, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-prop-2-enyl-6-propylpyridin-2-amine is sourced from PubChem (CID 103340202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).