N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide

C15H25N3O — CID 63059313

IUPACN-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide
SMILESCNC(=O)CN(C)c1ccccc1CNCC(C)C
InChIInChI=1S/C15H25N3O/c1-12(2)9-17-10-13-7-5-6-8-14(13)18(4)11-15(19)16-3/h5-8,12,17H,9-11H2,1-4H3,(H,16,19)
InChIKeyOFUPLWBCIDHMTN-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.61
Rot. Bonds7

About N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide

N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide (PubChem CID 63059313) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide
PubChem CID63059313
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide
SMILESCNC(=O)CN(C)c1ccccc1CNCC(C)C
InChIInChI=1S/C15H25N3O/c1-12(2)9-17-10-13-7-5-6-8-14(13)18(4)11-15(19)16-3/h5-8,12,17H,9-11H2,1-4H3,(H,16,19)
InChIKeyOFUPLWBCIDHMTN-UHFFFAOYSA-N
XLogP1.61
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 ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[N-ethyl-2-[(2-methylpropylamino)methyl]anilino]-N-methylacetamide
CID 63070317
2-[2-(hydroxymethyl)-N-methylanilino]-N-methylacetamide
CID 43375132
2-[2-[(tert-butylamino)methyl]-N-methylanilino]-N-methylacetamide
CID 63059312
N,N-dimethyl-2-[(2-methylpropylamino)methyl]aniline
CID 63058925
N-ethyl-2-[2-(ethylaminomethyl)-N-methylanilino]acetamide
CID 54980661
2-[2-chloro-N-methyl-4-[(2-methylpropylamino)methyl]anilino]-N-methylacetamide
CID 81149643
3-[2-(ethylaminomethyl)-N-methylanilino]-N-methylpropanamide
CID 106916760
N,N-bis(2-methylpropyl)-2-[(2-methylpropylamino)methyl]aniline
CID 63552275
N-(cyclobutylmethyl)-N-methyl-2-[(2-methylpropylamino)methyl]aniline
CID 63072459
N-methyl-2-[methyl-[5-[(2-methylpropylamino)methyl]-2-pyridinyl]amino]acetamide
CID 80630475
2-[4-chloro-N-methyl-2-[(2-methylpropylamino)methyl]anilino]-N-ethylacetamide
CID 114849464
N-methyl-2-[(2-methylpropylamino)methyl]-N-(pyridin-2-ylmethyl)aniline
CID 63060222

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide?
The IUPAC name of N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide (CID 63059313) is N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide.
What is the SMILES notation for N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide?
The canonical SMILES for N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide is CNC(=O)CN(C)c1ccccc1CNCC(C)C.
What is the InChIKey of N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide?
The InChIKey is OFUPLWBCIDHMTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-12(2)9-17-10-13-7-5-6-8-14(13)18(4)11-15(19)16-3/h5-8,12,17H,9-11H2,1-4H3,(H,16,19).
What are the key properties of N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide?
N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide has a molecular weight of 263.38 g/mol, XLogP of 1.61, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[N-methyl-2-[(2-methylpropylamino)methyl]anilino]acetamide is sourced from PubChem (CID 63059313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).