N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide

C25H25N3O4 — CID 11419031

IUPACN-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide
SMILESCOc1cc(C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)ccc1OCc1ccccn1
InChIInChI=1S/C25H25N3O4/c1-16-6-7-17(24(29)27-19-9-10-19)13-21(16)28-25(30)18-8-11-22(23(14-18)31-2)32-15-20-5-3-4-12-26-20/h3-8,11-14,19H,9-10,15H2,1-2H3,(H,27,29)(H,28,30)
InChIKeyRAKOHNQGABLKRA-UHFFFAOYSA-N
MW431.49 g/mol
LogP4.12
Rot. Bonds8

About N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide

N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide (PubChem CID 11419031) has the molecular formula C25H25N3O4 and a molecular weight of 431.49 g/mol. Its IUPAC name is N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide
PubChem CID11419031
Molecular FormulaC25H25N3O4
Molecular Weight431.49 g/mol
Exact Mass431.18
IUPAC NameN-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide
SMILESCOc1cc(C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)ccc1OCc1ccccn1
InChIInChI=1S/C25H25N3O4/c1-16-6-7-17(24(29)27-19-9-10-19)13-21(16)28-25(30)18-8-11-22(23(14-18)31-2)32-15-20-5-3-4-12-26-20/h3-8,11-14,19H,9-10,15H2,1-2H3,(H,27,29)(H,28,30)
InChIKeyRAKOHNQGABLKRA-UHFFFAOYSA-N
XLogP4.12
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.49
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide with MolForge

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Related Compounds

N-cyclopropyl-3-[[3-methoxy-4-[2-oxo-2-(propan-2-ylamino)ethoxy]benzoyl]amino]-4-methylbenzamide
CID 55786328
N-cyclopropyl-3-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzamide
CID 35558311
N-cyclopropyl-4-methyl-3-[[3-methyl-4-(1,2,5-thiadiazol-3-ylmethoxy)benzoyl]amino]benzamide
CID 11258737
N-cyclopropyl-3-[[2-(2-methoxyanilino)-2-oxoethyl]amino]-4-methylbenzamide
CID 55897484
methyl 5-[[4-[[5-(cyclopropylcarbamoyl)-2-methylphenyl]carbamoyl]-2-methylphenoxy]methyl]furan-2-carboxylate
CID 11385690
2-chloro-N-[5-(cyclopropylcarbamoyl)-2-methylphenyl]pyridine-4-carboxamide
CID 47047663
N-[5-(cyclopropylcarbamoyl)-2-methylphenyl]-2-(propylamino)pyridine-4-carboxamide
CID 59761490
4-(2-amino-2-oxoethoxy)-3-methoxy-N-(2-methylphenyl)benzamide
CID 8872324
methyl 2-[2-methoxy-4-[(1-pyridin-2-ylpiperidin-4-yl)carbamoyl]phenoxy]acetate
CID 55776583
3-methoxy-N-(3-pyridin-4-yl-4,5-dihydro-1H-pyrazol-5-yl)-4-(pyridin-2-ylmethoxy)benzamide
CID 145103722
N-cyclobutyl-4-methoxy-3-methylbenzamide
CID 121342416
N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide
CID 55879424

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide?
The IUPAC name of N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide (CID 11419031) is N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide.
What is the SMILES notation for N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide?
The canonical SMILES for N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide is COc1cc(C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)ccc1OCc1ccccn1.
What is the InChIKey of N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide?
The InChIKey is RAKOHNQGABLKRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O4/c1-16-6-7-17(24(29)27-19-9-10-19)13-21(16)28-25(30)18-8-11-22(23(14-18)31-2)32-15-20-5-3-4-12-26-20/h3-8,11-14,19H,9-10,15H2,1-2H3,(H,27,29)(H,28,30).
What are the key properties of N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide?
N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide has a molecular weight of 431.49 g/mol, XLogP of 4.12, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[[3-methoxy-4-(pyridin-2-ylmethoxy)benzoyl]amino]-4-methylbenzamide is sourced from PubChem (CID 11419031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).