N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide

C12H19N3O2 — CID 43199045

IUPACN-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide
SMILESCCC(C)NC(=O)CNc1ccc(OC)nc1
InChIInChI=1S/C12H19N3O2/c1-4-9(2)15-11(16)8-13-10-5-6-12(17-3)14-7-10/h5-7,9,13H,4,8H2,1-3H3,(H,15,16)
InChIKeyHOIVKCMNFSMTNV-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.42
Rot. Bonds6

About N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide

N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide (PubChem CID 43199045) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide
PubChem CID43199045
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC NameN-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide
SMILESCCC(C)NC(=O)CNc1ccc(OC)nc1
InChIInChI=1S/C12H19N3O2/c1-4-9(2)15-11(16)8-13-10-5-6-12(17-3)14-7-10/h5-7,9,13H,4,8H2,1-3H3,(H,15,16)
InChIKeyHOIVKCMNFSMTNV-UHFFFAOYSA-N
XLogP1.42
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide
CID 54957106
1-[(2R)-butan-2-yl]-3-(6-methoxy-3-pyridinyl)thiourea
CID 94841351
2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide
CID 54956647
N-butan-2-yl-2-[4-(6-methoxypyridine-3-carbonyl)piperazin-1-yl]acetamide
CID 134043905
(2S)-2-amino-N-(6-methoxy-3-pyridinyl)butanamide
CID 79025042
ethyl 2-(butan-2-ylamino)-2-(6-methoxy-3-pyridinyl)acetate
CID 114937457
2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide
CID 60853381
N-(2-bromoprop-2-enyl)-6-methoxypyridin-3-amine
CID 60873566
N,N-diethyl-2-[(6-methoxy-3-pyridinyl)amino]propanamide
CID 43114034
2-chloro-N-(6-methoxy-3-pyridinyl)acetamide
CID 2561820
6-methoxy-N-(4-methoxy-4-methylpentan-2-yl)pyridin-3-amine
CID 43146958
2-bromo-N-(6-methoxy-3-pyridinyl)propanamide
CID 107902789

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide?
The IUPAC name of N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide (CID 43199045) is N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide.
What is the SMILES notation for N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide?
The canonical SMILES for N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide is CCC(C)NC(=O)CNc1ccc(OC)nc1.
What is the InChIKey of N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide?
The InChIKey is HOIVKCMNFSMTNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-4-9(2)15-11(16)8-13-10-5-6-12(17-3)14-7-10/h5-7,9,13H,4,8H2,1-3H3,(H,15,16).
What are the key properties of N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide?
N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide has a molecular weight of 237.30 g/mol, XLogP of 1.42, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide is sourced from PubChem (CID 43199045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).