N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide

C22H30F2N4O4 — CID 163786451

IUPACN-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide
SMILESCC(=O)N[C@@H](CF)COCC1CCC(Oc2nc3cnc(OC4CC4)c(F)c3n2C)CC1
InChIInChI=1S/C22H30F2N4O4/c1-13(29)26-15(9-23)12-30-11-14-3-5-17(6-4-14)32-22-27-18-10-25-21(31-16-7-8-16)19(24)20(18)28(22)2/h10,14-17H,3-9,11-12H2,1-2H3,(H,26,29)/t14?,15-,17?/m0/s1
InChIKeyMSZIDZTWJRPUHQ-CKDBGZEDSA-N
MW452.50 g/mol
LogP3.08
Rot. Bonds10

About N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide

N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide (PubChem CID 163786451) has the molecular formula C22H30F2N4O4 and a molecular weight of 452.50 g/mol. Its IUPAC name is N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide.

Molecular Properties

Compound NameN-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide
PubChem CID163786451
Molecular FormulaC22H30F2N4O4
Molecular Weight452.50 g/mol
Exact Mass452.22
IUPAC NameN-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide
SMILESCC(=O)N[C@@H](CF)COCC1CCC(Oc2nc3cnc(OC4CC4)c(F)c3n2C)CC1
InChIInChI=1S/C22H30F2N4O4/c1-13(29)26-15(9-23)12-30-11-14-3-5-17(6-4-14)32-22-27-18-10-25-21(31-16-7-8-16)19(24)20(18)28(22)2/h10,14-17H,3-9,11-12H2,1-2H3,(H,26,29)/t14?,15-,17?/m0/s1
InChIKeyMSZIDZTWJRPUHQ-CKDBGZEDSA-N
XLogP3.08
TPSA87.50 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500452.50
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2S)-1-[4-[7-chloro-6-(3,3-difluorocyclobutyl)oxy-1-methylimidazo[4,5-c]pyridin-2-yl]oxycyclohexyl]oxypropan-2-yl]acetamide
CID 122497966
N-[(2S)-1-[4-(6-ethoxy-5,7-difluoro-1-methylbenzimidazol-2-yl)oxycyclohexyl]oxypropan-2-yl]acetamide
CID 122497819
methyl N-[[(2S)-1-[4-(7-chloro-6-cyclopropyloxy-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]oxypropan-2-yl]carbamoyl]carbamate
CID 122552333
N-[(2S)-1-[4-(5,6-difluoro-1-methylbenzimidazol-2-yl)oxycyclohexyl]oxypropan-2-yl]acetamide
CID 134357670
N-[(2S)-1-[4-[[7-fluoro-2-(oxetan-3-yloxy)-[1,3]thiazolo[4,5-c]pyridin-6-yl]oxy]cyclohexyl]oxypropan-2-yl]acetamide
CID 122497541
[(2S)-1-[4-(6-cyclopropyloxy-7-fluoro-1-methylbenzimidazol-2-yl)oxycyclohexyl]oxypropan-2-yl]urea
CID 134357666
N-[(2S)-1-[4-[[7-fluoro-2-[(3S)-oxolan-3-yl]oxy-[1,3]thiazolo[4,5-c]pyridin-6-yl]oxy]cyclohexyl]oxypropan-2-yl]acetamide
CID 122552183
N-[(2S)-1-[4-(7-chloro-6-ethoxy-4-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]oxypropan-2-yl]acetamide
CID 122498005
N-[(2S)-1-[4-[6-(3,3-difluorocyclobutyl)oxy-4,7-difluoro-1-methylbenzimidazol-2-yl]oxycyclohexyl]oxypropan-2-yl]acetamide
CID 122497878
N-[(2S)-1-[4-(6-cyclopropyloxy-4-fluoro-1-methylbenzimidazol-2-yl)oxycyclohexyl]oxy-4-fluorobutan-2-yl]acetamide
CID 134357689
N-[(2S)-1-[4-(1-methyl-5-propan-2-yloxybenzimidazol-2-yl)oxycyclohexyl]oxypropan-2-yl]acetamide
CID 122497786
2-cyclohexyloxy-6-ethoxy-7-fluoro-1-methylbenzimidazole
CID 154947071

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide?
The IUPAC name of N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide (CID 163786451) is N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide.
What is the SMILES notation for N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide?
The canonical SMILES for N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide is CC(=O)N[C@@H](CF)COCC1CCC(Oc2nc3cnc(OC4CC4)c(F)c3n2C)CC1.
What is the InChIKey of N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide?
The InChIKey is MSZIDZTWJRPUHQ-CKDBGZEDSA-N. The full InChI is InChI=1S/C22H30F2N4O4/c1-13(29)26-15(9-23)12-30-11-14-3-5-17(6-4-14)32-22-27-18-10-25-21(31-16-7-8-16)19(24)20(18)28(22)2/h10,14-17H,3-9,11-12H2,1-2H3,(H,26,29)/t14?,15-,17?/m0/s1.
What are the key properties of N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide?
N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide has a molecular weight of 452.50 g/mol, XLogP of 3.08, 10 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-[[4-(6-cyclopropyloxy-7-fluoro-1-methylimidazo[4,5-c]pyridin-2-yl)oxycyclohexyl]methoxy]-3-fluoropropan-2-yl]acetamide is sourced from PubChem (CID 163786451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).