5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine

C16H29N3O — CID 62183338

IUPAC5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ccc(CN(CCOC)CC(C)C)cn1
InChIInChI=1S/C16H29N3O/c1-5-8-17-16-7-6-15(11-18-16)13-19(9-10-20-4)12-14(2)3/h6-7,11,14H,5,8-10,12-13H2,1-4H3,(H,17,18)
InChIKeyBNOSMTLIQKDDQQ-UHFFFAOYSA-N
MW279.43 g/mol
LogP3.01
Rot. Bonds10

About 5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine

5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine (PubChem CID 62183338) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is 5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
PubChem CID62183338
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC Name5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ccc(CN(CCOC)CC(C)C)cn1
InChIInChI=1S/C16H29N3O/c1-5-8-17-16-7-6-15(11-18-16)13-19(9-10-20-4)12-14(2)3/h6-7,11,14H,5,8-10,12-13H2,1-4H3,(H,17,18)
InChIKeyBNOSMTLIQKDDQQ-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-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
CID 62469766
5-[(dipropylamino)methyl]-N-propylpyridin-2-amine
CID 62183383
2-[ethyl-[[6-(propylamino)-3-pyridinyl]methyl]amino]ethanol
CID 62182263
N,N,N'-trimethyl-N'-[[6-(propylamino)-3-pyridinyl]methyl]ethane-1,2-diamine
CID 63698946
5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine
CID 62183438
5-(3-methoxypropoxymethyl)-N-propylpyridin-2-amine
CID 62193134
5-(3-methoxypropylsulfanylmethyl)-N-propylpyridin-2-amine
CID 63857257
5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-2-methylaniline
CID 54985891
5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine
CID 62182940
5-(aminomethyl)-N-(2-methoxyethyl)pyridin-2-amine;methane
CID 160536663
5-(aminomethyl)-N-(2-methoxyethyl)pyridin-2-amine;dihydrochloride
CID 162339864
5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]-N-propylpyridin-2-amine
CID 62183942

Frequently Asked Questions

What is the IUPAC name of 5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine?
The IUPAC name of 5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine (CID 62183338) is 5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine?
The canonical SMILES for 5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine is CCCNc1ccc(CN(CCOC)CC(C)C)cn1.
What is the InChIKey of 5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine?
The InChIKey is BNOSMTLIQKDDQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c1-5-8-17-16-7-6-15(11-18-16)13-19(9-10-20-4)12-14(2)3/h6-7,11,14H,5,8-10,12-13H2,1-4H3,(H,17,18).
What are the key properties of 5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine?
5-[[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 5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 62183338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).