3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide

C11H23N3O2 — CID 103812840

IUPAC3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide
SMILESCNC(=O)C(C)CN(C)C(=O)C(C)(C)CN
InChIInChI=1S/C11H23N3O2/c1-8(9(15)13-4)6-14(5)10(16)11(2,3)7-12/h8H,6-7,12H2,1-5H3,(H,13,15)
InChIKeyBWYWGYQYKFRXBV-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.19
Rot. Bonds5

About 3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide

3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide (PubChem CID 103812840) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide.

Molecular Properties

Compound Name3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide
PubChem CID103812840
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide
SMILESCNC(=O)C(C)CN(C)C(=O)C(C)(C)CN
InChIInChI=1S/C11H23N3O2/c1-8(9(15)13-4)6-14(5)10(16)11(2,3)7-12/h8H,6-7,12H2,1-5H3,(H,13,15)
InChIKeyBWYWGYQYKFRXBV-UHFFFAOYSA-N
XLogP-0.19
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-3-[methyl-[2-methyl-2-(methylamino)propanoyl]amino]propanamide
CID 106915340
4-amino-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]pentanamide
CID 103812844
7-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]heptanamide
CID 103812823
3-[[2-(tert-butylamino)acetyl]-methylamino]-N,2-dimethylpropanamide
CID 103722241
tert-butyl 4-[methyl-[2-methyl-3-(methylamino)-3-oxopropyl]amino]-4-oxobutanoate
CID 106812542
N,2-dimethyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide
CID 103812841
1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide
CID 106915391
N,2-dimethyl-3-[methyl(prop-2-enoyl)amino]propanamide
CID 106915065
3-[2-aminoethyl(methyl)amino]-N,2-dimethylpropanamide;dihydrochloride
CID 86811726
3-amino-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]pentanamide
CID 106915366
(3S)-3-(aminomethyl)-N,5-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]hexanamide
CID 106915323
(2S)-2-amino-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]pentanamide;hydrochloride
CID 119818699

Frequently Asked Questions

What is the IUPAC name of 3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide?
The IUPAC name of 3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide (CID 103812840) is 3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide.
What is the SMILES notation for 3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide?
The canonical SMILES for 3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide is CNC(=O)C(C)CN(C)C(=O)C(C)(C)CN.
What is the InChIKey of 3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide?
The InChIKey is BWYWGYQYKFRXBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-8(9(15)13-4)6-14(5)10(16)11(2,3)7-12/h8H,6-7,12H2,1-5H3,(H,13,15).
What are the key properties of 3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide?
3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide has a molecular weight of 229.32 g/mol, XLogP of -0.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide is sourced from PubChem (CID 103812840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).