2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide

C15H23N3O — CID 43375210

IUPAC2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CN(C)c1ccccc1CNC1CC1
InChIInChI=1S/C15H23N3O/c1-17(2)15(19)11-18(3)14-7-5-4-6-12(14)10-16-13-8-9-13/h4-7,13,16H,8-11H2,1-3H3
InChIKeyNWZLPNMXPCAKBJ-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.46
Rot. Bonds6

About 2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide

2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide (PubChem CID 43375210) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide
PubChem CID43375210
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CN(C)c1ccccc1CNC1CC1
InChIInChI=1S/C15H23N3O/c1-17(2)15(19)11-18(3)14-7-5-4-6-12(14)10-16-13-8-9-13/h4-7,13,16H,8-11H2,1-3H3
InChIKeyNWZLPNMXPCAKBJ-UHFFFAOYSA-N
XLogP1.46
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-chloro-2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide
CID 43375220
2-[(cyclopropylamino)methyl]-N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylaniline
CID 105416055
2-[(cyclopropylamino)methyl]-N-methyl-N-pentan-3-ylaniline
CID 43571414
2-[2-chloro-6-[(cyclopropylamino)methyl]phenoxy]-N,N-dimethylacetamide
CID 112609936
2-[2-[(cyclopropylamino)methyl]-N-propan-2-ylanilino]ethanol
CID 54994770
1-[2-[(cyclopropylamino)methyl]phenyl]-N,N-dimethylpyrazole-3-carboxamide
CID 64782317
N,N-dimethyl-3-[(4-phenylcyclohexyl)amino]propanamide
CID 60925916
N-cyclopropyl-2-[4-[(cyclopropylamino)methyl]-N,3-dimethylanilino]acetamide
CID 62129290
ethyl 2-[2-[(cyclopropylamino)methyl]phenoxy]butanoate
CID 64669700
N-[[5-[(cyclopropylamino)methyl]thiophen-2-yl]methyl]-N,2-dimethylaniline
CID 107556404
N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine
CID 62436306
2-[2-[(cyclopropylamino)methyl]-4-fluorophenoxy]-N,N-dimethylacetamide
CID 107696376

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide?
The IUPAC name of 2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide (CID 43375210) is 2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide is CN(C)C(=O)CN(C)c1ccccc1CNC1CC1.
What is the InChIKey of 2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide?
The InChIKey is NWZLPNMXPCAKBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-17(2)15(19)11-18(3)14-7-5-4-6-12(14)10-16-13-8-9-13/h4-7,13,16H,8-11H2,1-3H3.
What are the key properties of 2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide?
2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide has a molecular weight of 261.37 g/mol, XLogP of 1.46, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(cyclopropylamino)methyl]-N-methylanilino]-N,N-dimethylacetamide is sourced from PubChem (CID 43375210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).