(2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide

C17H26N2O3 — CID 100775841

IUPAC(2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide
SMILESCCCCOc1ncc(NC(=O)[C@](C)(OC)C2CC2)cc1C
InChIInChI=1S/C17H26N2O3/c1-5-6-9-22-15-12(2)10-14(11-18-15)19-16(20)17(3,21-4)13-7-8-13/h10-11,13H,5-9H2,1-4H3,(H,19,20)/t17-/m1/s1
InChIKeyQCIKCWNHRDTZBQ-QGZVFWFLSA-N
MW306.41 g/mol
LogP3.32
Rot. Bonds8

About (2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide

(2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide (PubChem CID 100775841) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is (2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide.

Molecular Properties

Compound Name(2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide
PubChem CID100775841
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name(2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide
SMILESCCCCOc1ncc(NC(=O)[C@](C)(OC)C2CC2)cc1C
InChIInChI=1S/C17H26N2O3/c1-5-6-9-22-15-12(2)10-14(11-18-15)19-16(20)17(3,21-4)13-7-8-13/h10-11,13H,5-9H2,1-4H3,(H,19,20)/t17-/m1/s1
InChIKeyQCIKCWNHRDTZBQ-QGZVFWFLSA-N
XLogP3.32
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-cyclopropyl-N-(5-methyl-6-propoxy-3-pyridinyl)-2-propoxypropanamide
CID 100778809
(2S)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-ethoxy-2-methylhexanamide
CID 100776691
(2S)-2-cyclopropyl-N-(3,5-dimethyl-4-propoxyphenyl)-2-methoxypropanamide
CID 100709750
2-ethoxy-N-[6-(2-methoxyethoxy)-5-methyl-3-pyridinyl]-2-methylheptanamide
CID 133205786
(2R)-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methoxy-2-methylhexanamide
CID 100774797
(2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-methyl-2-propoxyheptanamide
CID 100778205
2-ethoxy-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methylhexanamide
CID 133205760
2-methoxy-N-[6-(2-methoxyethoxy)-5-methyl-3-pyridinyl]-2-methylbutanamide
CID 133205549
(2S)-2-ethoxy-N-(6-ethoxy-5-methyl-3-pyridinyl)-2-methylheptanamide
CID 100776825
2-cyclopropyl-2-methoxy-N-(4-propoxyphenyl)propanamide
CID 133246208
methyl 2-butoxy-5-[(2-cyclopropyl-2-methoxypropanoyl)amino]benzoate
CID 133229936
2,2,2-trichloro-N-(5-methyl-6-propoxy-3-pyridinyl)acetamide
CID 100773444

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide?
The IUPAC name of (2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide (CID 100775841) is (2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide.
What is the SMILES notation for (2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide?
The canonical SMILES for (2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide is CCCCOc1ncc(NC(=O)[C@](C)(OC)C2CC2)cc1C.
What is the InChIKey of (2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide?
The InChIKey is QCIKCWNHRDTZBQ-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-5-6-9-22-15-12(2)10-14(11-18-15)19-16(20)17(3,21-4)13-7-8-13/h10-11,13H,5-9H2,1-4H3,(H,19,20)/t17-/m1/s1.
What are the key properties of (2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide?
(2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide has a molecular weight of 306.41 g/mol, XLogP of 3.32, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(6-butoxy-5-methyl-3-pyridinyl)-2-cyclopropyl-2-methoxypropanamide is sourced from PubChem (CID 100775841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).