N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide

C19H22N2O2 — CID 118778909

IUPACN-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide
SMILESCOc1cccc(C)c1C(=O)NC(c1ncccc1C)C1CC1
InChIInChI=1S/C19H22N2O2/c1-12-6-4-8-15(23-3)16(12)19(22)21-18(14-9-10-14)17-13(2)7-5-11-20-17/h4-8,11,14,18H,9-10H2,1-3H3,(H,21,22)
InChIKeyMBKCGDPHCJXZLU-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.59
Rot. Bonds5

About N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide

N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide (PubChem CID 118778909) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide.

Molecular Properties

Compound NameN-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide
PubChem CID118778909
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide
SMILESCOc1cccc(C)c1C(=O)NC(c1ncccc1C)C1CC1
InChIInChI=1S/C19H22N2O2/c1-12-6-4-8-15(23-3)16(12)19(22)21-18(14-9-10-14)17-13(2)7-5-11-20-17/h4-8,11,14,18H,9-10H2,1-3H3,(H,21,22)
InChIKeyMBKCGDPHCJXZLU-UHFFFAOYSA-N
XLogP3.59
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-4-(6-methoxypyridazin-3-yl)benzamide
CID 119061888
N-[(S)-cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyrrol-1-ylacetamide
CID 125171906
N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-3-methoxy-2,2-dimethylpropanamide
CID 122569055
N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-(methylamino)-1,3-thiazole-4-carboxamide
CID 122563544
N-[(S)-cyclopropyl-(3-methyl-2-pyridinyl)methyl]-3-phenoxypropanamide
CID 125163176
N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide
CID 118791325
1-[(S)-cyclopropyl-(3-methyl-2-pyridinyl)methyl]-3-(1-methyl-3-propan-2-ylpyrazol-5-yl)urea
CID 125164383
[cyclobutyl-(3-methyl-2-pyridinyl)methyl]hydrazine
CID 105209352
N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-3,5-dimethyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide
CID 77084554
N-[(R)-cyclopropyl-(3-methyl-2-pyridinyl)methyl]-3-(1-ethyl-3,5-dimethylpyrazol-4-yl)benzamide
CID 125159915
[cycloheptyl-(3-methyl-2-pyridinyl)methyl]hydrazine
CID 105209201
N-[(S)-cyclopropyl-(3-methyl-2-pyridinyl)methyl]-4-pyrazol-1-ylbutanamide
CID 125160409

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide?
The IUPAC name of N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide (CID 118778909) is N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide.
What is the SMILES notation for N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide?
The canonical SMILES for N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide is COc1cccc(C)c1C(=O)NC(c1ncccc1C)C1CC1.
What is the InChIKey of N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide?
The InChIKey is MBKCGDPHCJXZLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-12-6-4-8-15(23-3)16(12)19(22)21-18(14-9-10-14)17-13(2)7-5-11-20-17/h4-8,11,14,18H,9-10H2,1-3H3,(H,21,22).
What are the key properties of N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide?
N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide has a molecular weight of 310.40 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide is sourced from PubChem (CID 118778909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).