N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide

C14H20N2O2 — CID 60686602

IUPACN-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide
SMILESCNCC(=O)N(Cc1ccc(OC)cc1)C1CC1
InChIInChI=1S/C14H20N2O2/c1-15-9-14(17)16(12-5-6-12)10-11-3-7-13(18-2)8-4-11/h3-4,7-8,12,15H,5-6,9-10H2,1-2H3
InChIKeyCWJHOWMHFNMSCE-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.41
Rot. Bonds6

About N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide

N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide (PubChem CID 60686602) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide
PubChem CID60686602
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide
SMILESCNCC(=O)N(Cc1ccc(OC)cc1)C1CC1
InChIInChI=1S/C14H20N2O2/c1-15-9-14(17)16(12-5-6-12)10-11-3-7-13(18-2)8-4-11/h3-4,7-8,12,15H,5-6,9-10H2,1-2H3
InChIKeyCWJHOWMHFNMSCE-UHFFFAOYSA-N
XLogP1.41
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-(methanesulfonamido)-N-[(4-methoxyphenyl)methyl]acetamide
CID 75462168
tert-butyl N-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-2-oxoethyl]carbamate
CID 60596382
3-amino-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]propanamide
CID 39350832
N-cyclopropyl-2-(methylamino)-N-[(4-propan-2-ylphenyl)methyl]acetamide;hydrochloride
CID 119693001
benzyl N-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-2-oxoethyl]carbamate
CID 60596354
2-tert-butylsulfanyl-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]acetamide
CID 134052775
4-amino-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]butanamide
CID 54869898
methyl 4-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-2-oxoethoxy]benzoate
CID 9019563
N-cyclohexyl-N-[(4-fluorophenyl)methyl]-2-(methylamino)acetamide
CID 119688726
N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-2-(methylamino)acetamide
CID 54872475
methyl 4-[cyclopropyl-[(4-methoxyphenyl)methyl]carbamoyl]benzoate
CID 9298633
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 31425201

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide?
The IUPAC name of N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide (CID 60686602) is N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide.
What is the SMILES notation for N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide?
The canonical SMILES for N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide is CNCC(=O)N(Cc1ccc(OC)cc1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide?
The InChIKey is CWJHOWMHFNMSCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-15-9-14(17)16(12-5-6-12)10-11-3-7-13(18-2)8-4-11/h3-4,7-8,12,15H,5-6,9-10H2,1-2H3.
What are the key properties of N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide?
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(methylamino)acetamide is sourced from PubChem (CID 60686602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).