6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine

C15H26N4O — CID 43261071

IUPAC6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine
SMILESCOc1nc(NCCCN2CCCCC2C)ccc1N
InChIInChI=1S/C15H26N4O/c1-12-6-3-4-10-19(12)11-5-9-17-14-8-7-13(16)15(18-14)20-2/h7-8,12H,3-6,9-11,16H2,1-2H3,(H,17,18)
InChIKeyXKZASNBVKAOVKI-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.35
Rot. Bonds6

About 6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine

6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine (PubChem CID 43261071) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine
PubChem CID43261071
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine
SMILESCOc1nc(NCCCN2CCCCC2C)ccc1N
InChIInChI=1S/C15H26N4O/c1-12-6-3-4-10-19(12)11-5-9-17-14-8-7-13(16)15(18-14)20-2/h7-8,12H,3-6,9-11,16H2,1-2H3,(H,17,18)
InChIKeyXKZASNBVKAOVKI-UHFFFAOYSA-N
XLogP2.35
TPSA63.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

6-ethoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine
CID 43261070
2-N-(2-cyclopentyloxyethyl)-6-methoxypyridine-2,5-diamine
CID 63826021
6-N,2-dimethyl-4-N-[3-(2-methylpiperidin-1-yl)propyl]pyrimidine-4,6-diamine
CID 80785894
N-[3-(2-methylpiperidin-1-yl)propyl]pyridazin-3-amine
CID 62483663
methyl 6-[3-(2-methylpiperidin-1-yl)propylamino]pyrazine-2-carboxylate
CID 66457281
1-[2-amino-5-[3-(2-methylpiperidin-1-yl)propylamino]phenyl]ethanone
CID 104612210
2-N-(2,6-dimethylpiperidin-1-yl)-6-methoxypyridine-2,5-diamine
CID 83003352
4-N-(3-methylbutyl)-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyrimidine-2,4-diamine
CID 154463494
4-chloro-6-methoxy-N-[3-(2-methylpiperidin-1-yl)propyl]-1,3,5-triazin-2-amine
CID 62857307
1-(2-methoxyethyl)-4-methyl-N-[3-(2-methylpiperidin-1-yl)propyl]imidazol-2-amine
CID 106557477
2-methoxy-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide
CID 134003012
5-methyl-N-[3-(2-methylpiperidin-1-yl)propyl]pyridazin-3-amine
CID 106549461

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine?
The IUPAC name of 6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine (CID 43261071) is 6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine.
What is the SMILES notation for 6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine?
The canonical SMILES for 6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine is COc1nc(NCCCN2CCCCC2C)ccc1N.
What is the InChIKey of 6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine?
The InChIKey is XKZASNBVKAOVKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-12-6-3-4-10-19(12)11-5-9-17-14-8-7-13(16)15(18-14)20-2/h7-8,12H,3-6,9-11,16H2,1-2H3,(H,17,18).
What are the key properties of 6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine?
6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine has a molecular weight of 278.40 g/mol, XLogP of 2.35, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2,5-diamine is sourced from PubChem (CID 43261071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).