N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide

C14H28N2O — CID 59205256

IUPACN-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide
SMILESCC(C)C(=O)NCCN(C)C1CCCCCC1
InChIInChI=1S/C14H28N2O/c1-12(2)14(17)15-10-11-16(3)13-8-6-4-5-7-9-13/h12-13H,4-11H2,1-3H3,(H,15,17)
InChIKeyOLHKMCVPUSLIMZ-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.41
Rot. Bonds5

About N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide

N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide (PubChem CID 59205256) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide
PubChem CID59205256
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide
SMILESCC(C)C(=O)NCCN(C)C1CCCCCC1
InChIInChI=1S/C14H28N2O/c1-12(2)14(17)15-10-11-16(3)13-8-6-4-5-7-9-13/h12-13H,4-11H2,1-3H3,(H,15,17)
InChIKeyOLHKMCVPUSLIMZ-UHFFFAOYSA-N
XLogP2.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[2-[methyl(oxan-4-yl)amino]ethyl]propanamide
CID 59205286
2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide
CID 63315824
N-[2-[acetyl(cyclopentyl)amino]ethyl]-2-methylpropanamide
CID 113052772
2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]butanamide
CID 63316290
2-bromo-N-[3-[cyclohexyl(methyl)amino]propyl]propanamide
CID 107904686
2-amino-N-[3-[cyclohexyl(methyl)amino]propyl]propanamide
CID 54880376
5-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]-2-methylpentanamide
CID 113441005
N-[3-[cyclohexyl(methyl)amino]propyl]-2-methoxypropanamide
CID 112685751
N-[3-[cyclohexyl(propan-2-yl)amino]propyl]-2-methylpropanamide
CID 59205246
3-amino-N-[3-[cyclohexyl(methyl)amino]propyl]-2-methylbutanamide;dihydrochloride
CID 120503009
4-[2-[cyclopentyl(methyl)amino]ethylcarbamoylamino]-2-hydroxybutanoic acid
CID 107839935
3-[2-[cyclopentyl(methyl)amino]ethyl]-1-ethyl-1-methylurea
CID 115613946

Frequently Asked Questions

What is the IUPAC name of N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide?
The IUPAC name of N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide (CID 59205256) is N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide.
What is the SMILES notation for N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide?
The canonical SMILES for N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide is CC(C)C(=O)NCCN(C)C1CCCCCC1.
What is the InChIKey of N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide?
The InChIKey is OLHKMCVPUSLIMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12(2)14(17)15-10-11-16(3)13-8-6-4-5-7-9-13/h12-13H,4-11H2,1-3H3,(H,15,17).
What are the key properties of N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide?
N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide has a molecular weight of 240.39 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide is sourced from PubChem (CID 59205256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).