N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide

C13H29N3O2 — CID 174612648

IUPACN,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide
SMILESCC(C)C(C(N)=O)C(C(N)=O)C(C)C.CN(C)C
InChIInChI=1S/C10H20N2O2.C3H9N/c1-5(2)7(9(11)13)8(6(3)4)10(12)14;1-4(2)3/h5-8H,1-4H3,(H2,11,13)(H2,12,14);1-3H3
InChIKeyTWDMUSMVTLVBRH-UHFFFAOYSA-N
MW259.39 g/mol
LogP0.68
Rot. Bonds5

About N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide

N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide (PubChem CID 174612648) has the molecular formula C13H29N3O2 and a molecular weight of 259.39 g/mol. Its IUPAC name is N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide.

Molecular Properties

Compound NameN,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide
PubChem CID174612648
Molecular FormulaC13H29N3O2
Molecular Weight259.39 g/mol
Exact Mass259.23
IUPAC NameN,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide
SMILESCC(C)C(C(N)=O)C(C(N)=O)C(C)C.CN(C)C
InChIInChI=1S/C10H20N2O2.C3H9N/c1-5(2)7(9(11)13)8(6(3)4)10(12)14;1-4(2)3/h5-8H,1-4H3,(H2,11,13)(H2,12,14);1-3H3
InChIKeyTWDMUSMVTLVBRH-UHFFFAOYSA-N
XLogP0.68
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride
CID 89440606
carbamic acid;N,N-dimethylmethanamine
CID 173358065
2,3-dimethylbutanediamide
CID 55281411
4-methyl-2-methylidene-3-propan-2-ylpentanamide
CID 141368866
(2S)-2-[acetyl(methyl)amino]propanamide
CID 55282132
(2S)-2-(dimethylamino)-3,3-dimethylbutanamide
CID 87149989
(2R)-2,3,3-trimethylbutanamide
CID 11579125
(2R)-2,3,3-trimethylbutanamide;(2S)-2,3,3-trimethylbutanamide
CID 143175420
3-hydroxy-4-methyl-2-oxopentanamide
CID 141452509
(2R,3S)-2,3-di(propan-2-yl)butanedioic acid
CID 95004211
2-aminopropanamide;dihydrochloride
CID 19963402
2-methylpropanamide;bis(propan-2-one)
CID 174404145

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide?
The IUPAC name of N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide (CID 174612648) is N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide.
What is the SMILES notation for N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide?
The canonical SMILES for N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide is CC(C)C(C(N)=O)C(C(N)=O)C(C)C.CN(C)C.
What is the InChIKey of N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide?
The InChIKey is TWDMUSMVTLVBRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2.C3H9N/c1-5(2)7(9(11)13)8(6(3)4)10(12)14;1-4(2)3/h5-8H,1-4H3,(H2,11,13)(H2,12,14);1-3H3.
What are the key properties of N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide?
N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide has a molecular weight of 259.39 g/mol, XLogP of 0.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide is sourced from PubChem (CID 174612648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).