4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine

C14H22N4O — CID 141155477

IUPAC4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine
SMILESCCOCc1nc2cnc(C)cc2n1CCCCN
InChIInChI=1S/C14H22N4O/c1-3-19-10-14-17-12-9-16-11(2)8-13(12)18(14)7-5-4-6-15/h8-9H,3-7,10,15H2,1-2H3
InChIKeyQDMHTOHRWFAQAF-UHFFFAOYSA-N
MW262.36 g/mol
LogP2.02
Rot. Bonds7

About 4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine

4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine (PubChem CID 141155477) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine.

Molecular Properties

Compound Name4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine
PubChem CID141155477
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine
SMILESCCOCc1nc2cnc(C)cc2n1CCCCN
InChIInChI=1S/C14H22N4O/c1-3-19-10-14-17-12-9-16-11(2)8-13(12)18(14)7-5-4-6-15/h8-9H,3-7,10,15H2,1-2H3
InChIKeyQDMHTOHRWFAQAF-UHFFFAOYSA-N
XLogP2.02
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-[2-(ethoxymethyl)-8-phenylmethoxyimidazo[4,5-c]quinolin-1-yl]butan-1-amine
CID 141108816
4-[2-[(4-methylphenoxy)methyl]benzimidazol-1-yl]butan-1-amine
CID 94747495
3-(5,6-dimethyl-2-propylbenzimidazol-1-yl)propan-1-amine
CID 82145072
4-[2-(phenoxymethyl)benzimidazol-1-yl]butan-1-amine
CID 82144770
5-[2-(ethoxymethyl)imidazo[4,5-c]quinolin-1-yl]pentanamide
CID 57447092
2-(cyclopropylmethyl)-6-methyl-1-(2-phenylmethoxyethyl)imidazo[4,5-c]pyridine
CID 141082466
3-(5,6-difluoro-2-propylbenzimidazol-1-yl)propan-1-amine
CID 82146076
O-[4-[2-(ethoxymethyl)imidazo[4,5-c]quinolin-1-yl]butyl] ethanethioate
CID 91445036
1-(4-aminobutyl)-7-benzyl-2-(ethoxymethyl)imidazo[4,5-c]quinolin-4-amine
CID 175941287
N-[4-[4-amino-2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butyl]naphthalene-2-carboxamide
CID 22729666
ethyl 3-[2-(ethoxymethyl)imidazo[4,5-c]quinolin-1-yl]propanoate
CID 57447047
4-[5,6-dichloro-2-(2-methylpropyl)benzimidazol-1-yl]butan-1-amine
CID 94749196

Frequently Asked Questions

What is the IUPAC name of 4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine?
The IUPAC name of 4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine (CID 141155477) is 4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine.
What is the SMILES notation for 4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine?
The canonical SMILES for 4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine is CCOCc1nc2cnc(C)cc2n1CCCCN.
What is the InChIKey of 4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine?
The InChIKey is QDMHTOHRWFAQAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-3-19-10-14-17-12-9-16-11(2)8-13(12)18(14)7-5-4-6-15/h8-9H,3-7,10,15H2,1-2H3.
What are the key properties of 4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine?
4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine has a molecular weight of 262.36 g/mol, XLogP of 2.02, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(ethoxymethyl)-6-methylimidazo[4,5-c]pyridin-1-yl]butan-1-amine is sourced from PubChem (CID 141155477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).