2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide

C15H25N3O — CID 62834119

IUPAC2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide
SMILESCNC(C)(C)C(=O)NCCCN(C)c1ccccc1
InChIInChI=1S/C15H25N3O/c1-15(2,16-3)14(19)17-11-8-12-18(4)13-9-6-5-7-10-13/h5-7,9-10,16H,8,11-12H2,1-4H3,(H,17,19)
InChIKeyNBOVKNIPPFHVRR-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.63
Rot. Bonds7

About 2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide

2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide (PubChem CID 62834119) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide.

Molecular Properties

Compound Name2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide
PubChem CID62834119
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide
SMILESCNC(C)(C)C(=O)NCCCN(C)c1ccccc1
InChIInChI=1S/C15H25N3O/c1-15(2,16-3)14(19)17-11-8-12-18(4)13-9-6-5-7-10-13/h5-7,9-10,16H,8,11-12H2,1-4H3,(H,17,19)
InChIKeyNBOVKNIPPFHVRR-UHFFFAOYSA-N
XLogP1.63
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-cyano-2-methyl-N-[3-(N-methylanilino)propyl]butanamide
CID 114290928
3-amino-3-methyl-N-[3-(N-methylanilino)propyl]butanamide
CID 64685522
N-[3-(N-methylanilino)propyl]benzamide
CID 18110891
2-tert-butylsulfanyl-N-[3-(N-methylanilino)propyl]acetamide
CID 78814923
2-methyl-N-[3-(N-methylanilino)propyl]prop-2-enamide
CID 154634175
2-[methyl-[3-(N-methylanilino)propylcarbamoyl]amino]acetic acid
CID 43135762
4-(methylamino)-N-[3-(N-methylanilino)propyl]butanamide;dihydrochloride
CID 119831619
1-benzyl-3-[3-(N-methylanilino)propyl]urea
CID 3497237
N-[3-(N-methylanilino)propyl]pentanamide
CID 78799629
4-methyl-N-[3-(N-methylanilino)propyl]benzamide
CID 27746793
2,2,2-trifluoroethyl N-[3-(N-methylanilino)propyl]carbamate
CID 65173936
N-[3-(N-methylanilino)propyl]pyridine-2-carboxamide
CID 31316694

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide?
The IUPAC name of 2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide (CID 62834119) is 2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide.
What is the SMILES notation for 2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide?
The canonical SMILES for 2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide is CNC(C)(C)C(=O)NCCCN(C)c1ccccc1.
What is the InChIKey of 2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide?
The InChIKey is NBOVKNIPPFHVRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-15(2,16-3)14(19)17-11-8-12-18(4)13-9-6-5-7-10-13/h5-7,9-10,16H,8,11-12H2,1-4H3,(H,17,19).
What are the key properties of 2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide?
2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide has a molecular weight of 263.38 g/mol, XLogP of 1.63, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(methylamino)-N-[3-(N-methylanilino)propyl]propanamide is sourced from PubChem (CID 62834119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).