1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide

C11H21N3O2 — CID 106915391

IUPAC1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide
SMILESCNC(=O)C(C)CN(C)C(=O)C1(N)CCC1
InChIInChI=1S/C11H21N3O2/c1-8(9(15)13-2)7-14(3)10(16)11(12)5-4-6-11/h8H,4-7,12H2,1-3H3,(H,13,15)
InChIKeyGGVVZJSWCUWSIC-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.29
Rot. Bonds4

About 1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide

1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide (PubChem CID 106915391) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide
PubChem CID106915391
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide
SMILESCNC(=O)C(C)CN(C)C(=O)C1(N)CCC1
InChIInChI=1S/C11H21N3O2/c1-8(9(15)13-2)7-14(3)10(16)11(12)5-4-6-11/h8H,4-7,12H2,1-3H3,(H,13,15)
InChIKeyGGVVZJSWCUWSIC-UHFFFAOYSA-N
XLogP-0.29
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-[1-(aminomethyl)cyclobutyl]acetyl]-methylamino]-N,2-dimethylpropanamide
CID 106915392
1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
CID 106915364
1-amino-N-methyl-N-(2-methylbutyl)cyclohexane-1-carboxamide
CID 43295917
4-methoxy-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]piperidine-4-carboxamide
CID 119818688
N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]-3-propylpiperidine-3-carboxamide
CID 106915355
3-amino-N,2,2-trimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]propanamide
CID 103812840
N,2-dimethyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide
CID 103812841
4-amino-N-methyl-N-(2-methylpropyl)oxane-4-carboxamide
CID 115293667
4-methyl-1-[methyl-[2-methyl-3-(methylamino)-3-oxopropyl]carbamoyl]piperidine-4-carboxylic acid
CID 106917346
N,3-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]piperidine-1-carboxamide
CID 106915097
N,2-dimethyl-3-[methyl(prop-2-enoyl)amino]propanamide
CID 106915065
4-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
CID 113264331

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide?
The IUPAC name of 1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide (CID 106915391) is 1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide.
What is the SMILES notation for 1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide?
The canonical SMILES for 1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide is CNC(=O)C(C)CN(C)C(=O)C1(N)CCC1.
What is the InChIKey of 1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide?
The InChIKey is GGVVZJSWCUWSIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-8(9(15)13-2)7-14(3)10(16)11(12)5-4-6-11/h8H,4-7,12H2,1-3H3,(H,13,15).
What are the key properties of 1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide?
1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide has a molecular weight of 227.31 g/mol, XLogP of -0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide is sourced from PubChem (CID 106915391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).