5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide

C14H27N3O2 — CID 106918224

IUPAC5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
SMILESCNC(=O)C(C)CN(C)C(=O)C1CC(N)CCC1C
InChIInChI=1S/C14H27N3O2/c1-9-5-6-11(15)7-12(9)14(19)17(4)8-10(2)13(18)16-3/h9-12H,5-8,15H2,1-4H3,(H,16,18)
InChIKeyYAAODMGNCDBWEZ-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.59
Rot. Bonds4

About 5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide

5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide (PubChem CID 106918224) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
PubChem CID106918224
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
SMILESCNC(=O)C(C)CN(C)C(=O)C1CC(N)CCC1C
InChIInChI=1S/C14H27N3O2/c1-9-5-6-11(15)7-12(9)14(19)17(4)8-10(2)13(18)16-3/h9-12H,5-8,15H2,1-4H3,(H,16,18)
InChIKeyYAAODMGNCDBWEZ-UHFFFAOYSA-N
XLogP0.59
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
CID 113264331
2-amino-N,5-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
CID 106918225
3-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
CID 113267257
5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide
CID 63961904
N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxamide
CID 91646308
3-amino-N-(2-hydroxypropyl)-N-methylcyclopentane-1-carboxamide
CID 66007556
N-(3-amino-3-hydroxyimino-2-methylpropyl)-N,2-dimethylcyclopropane-1-carboxamide
CID 76910906
5-amino-N-(2-methoxyethyl)-2-methyl-N-(2-methylpropyl)cyclohexane-1-carboxamide
CID 55117060
5-amino-N-[4-(dimethylamino)butan-2-yl]-2-methylcyclohexane-1-carboxamide
CID 62782765
N-(3-amino-2-methyl-3-sulfanylidenepropyl)-N,2-dimethylcyclopentane-1-carboxamide
CID 107178688
(2S)-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide;hydrochloride
CID 119818675
5-amino-N,2-dimethyl-N-(1-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 62781149

Frequently Asked Questions

What is the IUPAC name of 5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide?
The IUPAC name of 5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide (CID 106918224) is 5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide?
The canonical SMILES for 5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide is CNC(=O)C(C)CN(C)C(=O)C1CC(N)CCC1C.
What is the InChIKey of 5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide?
The InChIKey is YAAODMGNCDBWEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-9-5-6-11(15)7-12(9)14(19)17(4)8-10(2)13(18)16-3/h9-12H,5-8,15H2,1-4H3,(H,16,18).
What are the key properties of 5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide?
5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 0.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N,2-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 106918224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).