2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide

C14H20N2O — CID 43401776

IUPAC2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CNC(C)C2CC2)c1
InChIInChI=1S/C14H20N2O/c1-10-4-3-5-13(8-10)16-14(17)9-15-11(2)12-6-7-12/h3-5,8,11-12,15H,6-7,9H2,1-2H3,(H,16,17)
InChIKeyKPDZPTMMFXJMAA-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.32
Rot. Bonds5

About 2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide

2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide (PubChem CID 43401776) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide
PubChem CID43401776
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CNC(C)C2CC2)c1
InChIInChI=1S/C14H20N2O/c1-10-4-3-5-13(8-10)16-14(17)9-15-11(2)12-6-7-12/h3-5,8,11-12,15H,6-7,9H2,1-2H3,(H,16,17)
InChIKeyKPDZPTMMFXJMAA-UHFFFAOYSA-N
XLogP2.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methylphenyl)-2-[1-(oxan-4-yl)ethylamino]acetamide
CID 84598905
N-(3-chlorophenyl)-2-(1-cyclopropylethylamino)acetamide
CID 43401773
N-methyl-2-[[2-(3-methylanilino)-2-oxoethyl]amino]propanamide
CID 54950375
2-[[2-(3-methylanilino)-2-oxoethyl]amino]propanoic acid
CID 43467219
2-[[(1S)-1-cyclohexylethyl]amino]-N-(3-methoxyphenyl)acetamide
CID 81388783
2-[[(2S)-butan-2-yl]amino]-N-(3-methylphenyl)acetamide
CID 2386923
N-(3-methylphenyl)-2-(pentan-2-ylamino)acetamide
CID 43179547
2-(but-3-yn-2-ylamino)-N-(3-methylphenyl)acetamide
CID 114416946
2-[(4-hydroxy-3-methylbutan-2-yl)amino]-N-(3-methylphenyl)acetamide
CID 104696391
N-(2-bromophenyl)-2-(1-cyclopropylethylamino)acetamide
CID 43401788
N-(3-methylphenyl)-2-[[(1R)-1-pyridin-4-ylethyl]amino]acetamide
CID 81409885
2-(6-methylheptan-2-ylamino)-N-(3-methylphenyl)acetamide
CID 60647450

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide (CID 43401776) is 2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide is Cc1cccc(NC(=O)CNC(C)C2CC2)c1.
What is the InChIKey of 2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide?
The InChIKey is KPDZPTMMFXJMAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10-4-3-5-13(8-10)16-14(17)9-15-11(2)12-6-7-12/h3-5,8,11-12,15H,6-7,9H2,1-2H3,(H,16,17).
What are the key properties of 2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide?
2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide has a molecular weight of 232.33 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 43401776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).