[4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone

C21H30N6O3 — CID 97447598

IUPAC[4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone
SMILESCn1cnc2c(N3CCOCC3)nc(C3CCN(C(=O)N4CCOCC4)CC3)cc21
InChIInChI=1S/C21H30N6O3/c1-24-15-22-19-18(24)14-17(23-20(19)25-6-10-29-11-7-25)16-2-4-26(5-3-16)21(28)27-8-12-30-13-9-27/h14-16H,2-13H2,1H3
InChIKeyTUTFWVRQYANKMV-UHFFFAOYSA-N
MW414.51 g/mol
LogP1.44
Rot. Bonds2

About [4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone

[4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone (PubChem CID 97447598) has the molecular formula C21H30N6O3 and a molecular weight of 414.51 g/mol. Its IUPAC name is [4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone
PubChem CID97447598
Molecular FormulaC21H30N6O3
Molecular Weight414.51 g/mol
Exact Mass414.24
IUPAC Name[4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone
SMILESCn1cnc2c(N3CCOCC3)nc(C3CCN(C(=O)N4CCOCC4)CC3)cc21
InChIInChI=1S/C21H30N6O3/c1-24-15-22-19-18(24)14-17(23-20(19)25-6-10-29-11-7-25)16-2-4-26(5-3-16)21(28)27-8-12-30-13-9-27/h14-16H,2-13H2,1H3
InChIKeyTUTFWVRQYANKMV-UHFFFAOYSA-N
XLogP1.44
TPSA75.96 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.51
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

[4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone
CID 97447633
N,N-dimethyl-4-(1-methyl-4-pyridin-3-ylimidazo[4,5-c]pyridin-6-yl)piperidine-1-carboxamide
CID 97415290
6-cyclopropyl-N-methyl-3-[1-(morpholine-4-carbonyl)pyrrolidin-3-yl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 134802014
[4-[4-(4-methoxyphenyl)-1-methylimidazo[4,5-c]pyridin-6-yl]piperidin-1-yl]-thiophen-2-ylmethanone
CID 97415324
1-(6-cyclopropyl-2-morpholin-4-yl-3-pyridinyl)ethanone
CID 126497930
[1-(9-methylpurin-6-yl)azetidin-3-yl]-morpholin-4-ylmethanone
CID 163351886
furan-3-yl-[4-(1-methyl-4-phenylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]methanone;2,2,2-trifluoroacetic acid
CID 155850386
6-(1-cyclopropylsulfonylpiperidin-4-yl)-1-methyl-4-(1-methylpyrazol-4-yl)imidazo[4,5-c]pyridine
CID 97407527
6-chloro-1-methyl-4-(oxan-4-yl)imidazo[4,5-c]pyridine
CID 163273561
[4-(1-methyl-4-pyridin-3-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-phenylmethanone;bis(2,2,2-trifluoroacetic acid)
CID 155837911
morpholin-4-yl-(4-phenylpiperidin-1-yl)methanone
CID 67308530
(2R)-2-methyl-1-[4-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)piperidin-1-yl]pentan-1-one
CID 95883020

Frequently Asked Questions

What is the IUPAC name of [4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone?
The IUPAC name of [4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone (CID 97447598) is [4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone is Cn1cnc2c(N3CCOCC3)nc(C3CCN(C(=O)N4CCOCC4)CC3)cc21.
What is the InChIKey of [4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone?
The InChIKey is TUTFWVRQYANKMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N6O3/c1-24-15-22-19-18(24)14-17(23-20(19)25-6-10-29-11-7-25)16-2-4-26(5-3-16)21(28)27-8-12-30-13-9-27/h14-16H,2-13H2,1H3.
What are the key properties of [4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone?
[4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone has a molecular weight of 414.51 g/mol, XLogP of 1.44, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 97447598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).