N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide

C15H23N3O2 — CID 43568691

IUPACN-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide
SMILESCOc1ccc(NC(=O)CN(C)C(C)C2CC2)c(N)c1
InChIInChI=1S/C15H23N3O2/c1-10(11-4-5-11)18(2)9-15(19)17-14-7-6-12(20-3)8-13(14)16/h6-8,10-11H,4-5,9,16H2,1-3H3,(H,17,19)
InChIKeyKHINECGKMYWBJK-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.95
Rot. Bonds6

About N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide

N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide (PubChem CID 43568691) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide
PubChem CID43568691
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide
SMILESCOc1ccc(NC(=O)CN(C)C(C)C2CC2)c(N)c1
InChIInChI=1S/C15H23N3O2/c1-10(11-4-5-11)18(2)9-15(19)17-14-7-6-12(20-3)8-13(14)16/h6-8,10-11H,4-5,9,16H2,1-3H3,(H,17,19)
InChIKeyKHINECGKMYWBJK-UHFFFAOYSA-N
XLogP1.95
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-4-methoxyphenyl)-2-[methyl(thiolan-3-yl)amino]acetamide
CID 43296339
N-(5-amino-2-methylphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide
CID 43568692
N-(2-amino-4-methoxyphenyl)-2-[2-hydroxyethyl(methyl)amino]acetamide
CID 54879538
N-(5-amino-2-chlorophenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide
CID 43568654
N-(2-amino-4-methoxyphenyl)-3-[methyl(3-methylbutan-2-yl)amino]propanamide
CID 43569669
N-(2-amino-4-methoxyphenyl)-4-[butan-2-yl(methyl)amino]butanamide
CID 43272559
N-(2-amino-4-fluorophenyl)-3-[1-cyclopropylethyl(methyl)amino]propanamide
CID 43568695
N-(2-amino-4-methoxyphenyl)-2-cycloheptylacetamide
CID 114457002
2-[1-cyclopropylethyl(methyl)amino]-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 134022522
N-(2-amino-4-methoxyphenyl)-3-[methyl(thiolan-3-yl)amino]propanamide
CID 43296316
N-(2-amino-4-methoxyphenyl)-3-propan-2-ylsulfonylpropanamide
CID 60884521
N-(2-amino-4-methoxyphenyl)-2-propan-2-ylsulfinylacetamide
CID 61286623

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide?
The IUPAC name of N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide (CID 43568691) is N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide.
What is the SMILES notation for N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide?
The canonical SMILES for N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide is COc1ccc(NC(=O)CN(C)C(C)C2CC2)c(N)c1.
What is the InChIKey of N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide?
The InChIKey is KHINECGKMYWBJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-10(11-4-5-11)18(2)9-15(19)17-14-7-6-12(20-3)8-13(14)16/h6-8,10-11H,4-5,9,16H2,1-3H3,(H,17,19).
What are the key properties of N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide?
N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.95, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-methoxyphenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide is sourced from PubChem (CID 43568691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).