1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

C13H23N3O — CID 64858544

IUPAC1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCCOCC(C)n1c(CC)nc2c1CCNC2
InChIInChI=1S/C13H23N3O/c1-4-13-15-11-8-14-7-6-12(11)16(13)10(3)9-17-5-2/h10,14H,4-9H2,1-3H3
InChIKeyNLDJFCJYDJGPFI-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.69
Rot. Bonds5

About 1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 64858544) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID64858544
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCCOCC(C)n1c(CC)nc2c1CCNC2
InChIInChI=1S/C13H23N3O/c1-4-13-15-11-8-14-7-6-12(11)16(13)10(3)9-17-5-2/h10,14H,4-9H2,1-3H3
InChIKeyNLDJFCJYDJGPFI-UHFFFAOYSA-N
XLogP1.69
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-ethoxypropan-2-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858742
2-ethyl-1-(4-methylsulfinylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 113493743
2-ethyl-1-(2-methylpentan-3-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857955
1-(1-cyclopropylbutan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857939
1-(4-methoxybutan-2-yl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858971
1-(6-methylheptan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64859159
2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858954
1-tert-butyl-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856930
1-(cyclopropylmethyl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857297
1-(2-ethoxyethyl)-2-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857673
1-[4-(difluoromethoxy)phenyl]-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857907
4-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-N-methyl-N-propan-2-ylbutan-1-amine
CID 64858349

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 64858544) is 1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is CCOCC(C)n1c(CC)nc2c1CCNC2.
What is the InChIKey of 1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is NLDJFCJYDJGPFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-4-13-15-11-8-14-7-6-12(11)16(13)10(3)9-17-5-2/h10,14H,4-9H2,1-3H3.
What are the key properties of 1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 237.35 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethoxypropan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 64858544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).