2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide

C15H23N3O3 — CID 60852115

IUPAC2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide
SMILESCCC(C)NCC(=O)Nc1cccc(OCC(=O)NC)c1
InChIInChI=1S/C15H23N3O3/c1-4-11(2)17-9-14(19)18-12-6-5-7-13(8-12)21-10-15(20)16-3/h5-8,11,17H,4,9-10H2,1-3H3,(H,16,20)(H,18,19)
InChIKeyFRKLWTCQKFVGIJ-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.14
Rot. Bonds8

About 2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide

2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide (PubChem CID 60852115) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide
PubChem CID60852115
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide
SMILESCCC(C)NCC(=O)Nc1cccc(OCC(=O)NC)c1
InChIInChI=1S/C15H23N3O3/c1-4-11(2)17-9-14(19)18-12-6-5-7-13(8-12)21-10-15(20)16-3/h5-8,11,17H,4,9-10H2,1-3H3,(H,16,20)(H,18,19)
InChIKeyFRKLWTCQKFVGIJ-UHFFFAOYSA-N
XLogP1.14
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide
CID 43179380
2-(butan-2-ylamino)-N-[3-[2-(dimethylamino)ethoxy]phenyl]acetamide
CID 60852855
2-amino-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide
CID 43705402
2-bromo-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]butanamide
CID 62855576
2-[[(2S)-butan-2-yl]amino]-N-(3-methylphenyl)acetamide
CID 2386923
2-(butan-2-ylamino)-N-(3-hydroxyphenyl)acetamide
CID 61166125
N-methyl-2-[3-(2-methylbutylamino)phenoxy]acetamide
CID 43693352
2-(1-hydroxypropan-2-ylamino)-N-(3-methoxyphenyl)acetamide
CID 43499874
N-[3-[2-(1-hydroxybutan-2-ylamino)-2-oxoethoxy]phenyl]propanamide
CID 50967022
2-[3-(butan-2-ylcarbamoylamino)phenoxy]acetic acid
CID 61188461
2-(butan-2-ylamino)-N-[3-(dimethylamino)phenyl]acetamide
CID 115376908
N-(3-methoxyphenyl)-2-(3-methylpentan-2-ylamino)acetamide
CID 61463325

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide (CID 60852115) is 2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide is CCC(C)NCC(=O)Nc1cccc(OCC(=O)NC)c1.
What is the InChIKey of 2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide?
The InChIKey is FRKLWTCQKFVGIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-4-11(2)17-9-14(19)18-12-6-5-7-13(8-12)21-10-15(20)16-3/h5-8,11,17H,4,9-10H2,1-3H3,(H,16,20)(H,18,19).
What are the key properties of 2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide?
2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide has a molecular weight of 293.37 g/mol, XLogP of 1.14, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide is sourced from PubChem (CID 60852115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).