4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine

C16H29N3O — CID 62469766

IUPAC4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1cc(CN(CCOC)CC(C)C)ccn1
InChIInChI=1S/C16H29N3O/c1-5-7-17-16-11-15(6-8-18-16)13-19(9-10-20-4)12-14(2)3/h6,8,11,14H,5,7,9-10,12-13H2,1-4H3,(H,17,18)
InChIKeySBUOFWKUOAJWRC-UHFFFAOYSA-N
MW279.43 g/mol
LogP3.01
Rot. Bonds10

About 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine

4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine (PubChem CID 62469766) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
PubChem CID62469766
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC Name4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1cc(CN(CCOC)CC(C)C)ccn1
InChIInChI=1S/C16H29N3O/c1-5-7-17-16-11-15(6-8-18-16)13-19(9-10-20-4)12-14(2)3/h6,8,11,14H,5,7,9-10,12-13H2,1-4H3,(H,17,18)
InChIKeySBUOFWKUOAJWRC-UHFFFAOYSA-N
XLogP3.01
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[ethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
CID 62470960
5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
CID 62183338
4-(diethylaminomethyl)-N-propylpyridin-2-amine
CID 62472000
4-[[methyl(3-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
CID 62465932
4-[[bis(2-methylpropyl)amino]methyl]-N-methylpyridin-2-amine
CID 55075749
4-(2-methoxyethoxymethyl)-N-propylpyridin-2-amine
CID 62466363
4-[[methyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
CID 62469698
4-[[ethyl(methyl)amino]methyl]-N-propylpyridin-2-amine
CID 62472407
5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-2-methylaniline
CID 54985891
2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine
CID 113367660
4-N-cyclopropyl-4-N-(2-methoxyethyl)-2-N-propylpyridine-2,4-diamine
CID 113367615
4-[(4-methoxy-N-methylanilino)methyl]-N-propylpyridin-2-amine
CID 62464640

Frequently Asked Questions

What is the IUPAC name of 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine?
The IUPAC name of 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine (CID 62469766) is 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine?
The canonical SMILES for 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine is CCCNc1cc(CN(CCOC)CC(C)C)ccn1.
What is the InChIKey of 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine?
The InChIKey is SBUOFWKUOAJWRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c1-5-7-17-16-11-15(6-8-18-16)13-19(9-10-20-4)12-14(2)3/h6,8,11,14H,5,7,9-10,12-13H2,1-4H3,(H,17,18).
What are the key properties of 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine?
4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine has a molecular weight of 279.43 g/mol, XLogP of 3.01, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 62469766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).