2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine

C15H26N4O — CID 62547989

IUPAC2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine
SMILESCCCOc1nc(N(C)C2CCCN(C)C2)ccc1N
InChIInChI=1S/C15H26N4O/c1-4-10-20-15-13(16)7-8-14(17-15)19(3)12-6-5-9-18(2)11-12/h7-8,12H,4-6,9-11,16H2,1-3H3
InChIKeyJVYTWXMKZAWHFG-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.98
Rot. Bonds5

About 2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine

2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine (PubChem CID 62547989) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine
PubChem CID62547989
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine
SMILESCCCOc1nc(N(C)C2CCCN(C)C2)ccc1N
InChIInChI=1S/C15H26N4O/c1-4-10-20-15-13(16)7-8-14(17-15)19(3)12-6-5-9-18(2)11-12/h7-8,12H,4-6,9-11,16H2,1-3H3
InChIKeyJVYTWXMKZAWHFG-UHFFFAOYSA-N
XLogP1.98
TPSA54.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 62545515
2-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-N-methyl-6-propoxypyridine-2,5-diamine
CID 79303922
4-N-methyl-4-N-(1-methylpiperidin-3-yl)pyrimidine-2,4-diamine
CID 80832213
2-N-ethyl-4-N-methyl-4-N-(1-methylpiperidin-3-yl)pyrimidine-2,4-diamine
CID 80832495
6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-propoxypyridin-3-amine
CID 115558857
6-N-ethyl-4-N-methyl-4-N-(1-methylpiperidin-3-yl)pyrimidine-4,6-diamine
CID 80832211
6-hydrazinyl-N-methyl-N-(1-methylpiperidin-3-yl)pyridin-2-amine
CID 80919138
5-(chloromethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyridin-2-amine
CID 55084380
2-N-[2-(dimethylamino)ethyl]-2-N-methyl-6-propoxypyridine-2,5-diamine
CID 63694450
2-N-cyclopentyl-2-N-methyl-6-propan-2-yloxypyridine-2,5-diamine
CID 43266923
6-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-2-propoxypyridin-3-amine
CID 43628006
2-N-(cyclohexylmethyl)-6-ethoxy-2-N-methylpyridine-2,5-diamine
CID 63402666

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine?
The IUPAC name of 2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine (CID 62547989) is 2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine.
What is the SMILES notation for 2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine?
The canonical SMILES for 2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine is CCCOc1nc(N(C)C2CCCN(C)C2)ccc1N.
What is the InChIKey of 2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine?
The InChIKey is JVYTWXMKZAWHFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-4-10-20-15-13(16)7-8-14(17-15)19(3)12-6-5-9-18(2)11-12/h7-8,12H,4-6,9-11,16H2,1-3H3.
What are the key properties of 2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine?
2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine has a molecular weight of 278.40 g/mol, XLogP of 1.98, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-propoxypyridine-2,5-diamine is sourced from PubChem (CID 62547989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).