(7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine

C16H23N3O2 — CID 97382848

IUPAC(7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine
SMILESCCOC[C@@H]1CN(Cc2ccc(C)o2)Cc2ncn(C)c21
InChIInChI=1S/C16H23N3O2/c1-4-20-10-13-7-19(8-14-6-5-12(2)21-14)9-15-16(13)18(3)11-17-15/h5-6,11,13H,4,7-10H2,1-3H3/t13-/m0/s1
InChIKeyHIDCJFDOQASLTO-ZDUSSCGKSA-N
MW289.38 g/mol
LogP2.46
Rot. Bonds5

About (7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine

(7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine (PubChem CID 97382848) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is (7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name(7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine
PubChem CID97382848
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name(7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine
SMILESCCOC[C@@H]1CN(Cc2ccc(C)o2)Cc2ncn(C)c21
InChIInChI=1S/C16H23N3O2/c1-4-20-10-13-7-19(8-14-6-5-12(2)21-14)9-15-16(13)18(3)11-17-15/h5-6,11,13H,4,7-10H2,1-3H3/t13-/m0/s1
InChIKeyHIDCJFDOQASLTO-ZDUSSCGKSA-N
XLogP2.46
TPSA43.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(7S)-7-(methoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 97382827
(7R)-1-(cyclopropylmethyl)-7-(ethoxymethyl)-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 97382954
4-(ethoxymethyl)-2-methyl-6-[(5-methylfuran-2-yl)methyl]-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine
CID 131652990
7-(ethoxymethyl)-5-[(4-methoxyphenyl)methyl]-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 131651604
7-(ethoxymethyl)-2-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
CID 131654634
(7S)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-7-(pyridin-4-ylmethoxymethyl)-6,7-dihydro-4H-triazolo[4,5-c]pyridine
CID 97383391
(7S)-7-(ethoxymethyl)-1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 97382865
2-(cyclopropylmethyl)-7-(ethoxymethyl)-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
CID 131650589
7-(ethoxymethyl)-5-[(5-methylfuran-2-yl)methyl]-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine
CID 131644437
(3,3-difluoroazetidin-1-yl)-[1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methanone;2,2,2-trifluoroacetic acid
CID 155862320
(7R)-1,5-bis(cyclopropylmethyl)-7-(ethoxymethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 97382972
4-[[(7R)-7-(methoxymethyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl]methyl]-3,5-dimethyl-1,2-oxazole
CID 97368230

Frequently Asked Questions

What is the IUPAC name of (7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
The IUPAC name of (7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine (CID 97382848) is (7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine.
What is the SMILES notation for (7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
The canonical SMILES for (7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine is CCOC[C@@H]1CN(Cc2ccc(C)o2)Cc2ncn(C)c21.
What is the InChIKey of (7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
The InChIKey is HIDCJFDOQASLTO-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-4-20-10-13-7-19(8-14-6-5-12(2)21-14)9-15-16(13)18(3)11-17-15/h5-6,11,13H,4,7-10H2,1-3H3/t13-/m0/s1.
What are the key properties of (7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
(7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine has a molecular weight of 289.38 g/mol, XLogP of 2.46, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-7-(ethoxymethyl)-1-methyl-5-[(5-methylfuran-2-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 97382848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).