N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine

C23H34N6O2 — CID 97447667

IUPACN-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine
SMILESCOCCN(C)c1nc(C2CCN(Cc3cc(C)on3)CC2)cc2c1ncn2C(C)C
InChIInChI=1S/C23H34N6O2/c1-16(2)29-15-24-22-21(29)13-20(25-23(22)27(4)10-11-30-5)18-6-8-28(9-7-18)14-19-12-17(3)31-26-19/h12-13,15-16,18H,6-11,14H2,1-5H3
InChIKeyLNZIFVWHOYDRKP-UHFFFAOYSA-N
MW426.57 g/mol
LogP3.77
Rot. Bonds8

About N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine

N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine (PubChem CID 97447667) has the molecular formula C23H34N6O2 and a molecular weight of 426.57 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine
PubChem CID97447667
Molecular FormulaC23H34N6O2
Molecular Weight426.57 g/mol
Exact Mass426.27
IUPAC NameN-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine
SMILESCOCCN(C)c1nc(C2CCN(Cc3cc(C)on3)CC2)cc2c1ncn2C(C)C
InChIInChI=1S/C23H34N6O2/c1-16(2)29-15-24-22-21(29)13-20(25-23(22)27(4)10-11-30-5)18-6-8-28(9-7-18)14-19-12-17(3)31-26-19/h12-13,15-16,18H,6-11,14H2,1-5H3
InChIKeyLNZIFVWHOYDRKP-UHFFFAOYSA-N
XLogP3.77
TPSA72.45 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.57
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine?
The IUPAC name of N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine (CID 97447667) is N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine is COCCN(C)c1nc(C2CCN(Cc3cc(C)on3)CC2)cc2c1ncn2C(C)C.
What is the InChIKey of N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine?
The InChIKey is LNZIFVWHOYDRKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N6O2/c1-16(2)29-15-24-22-21(29)13-20(25-23(22)27(4)10-11-30-5)18-6-8-28(9-7-18)14-19-12-17(3)31-26-19/h12-13,15-16,18H,6-11,14H2,1-5H3.
What are the key properties of N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine?
N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine has a molecular weight of 426.57 g/mol, XLogP of 3.77, 8 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-methyl-6-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-propan-2-ylimidazo[4,5-c]pyridin-4-amine is sourced from PubChem (CID 97447667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).