N-methyl-2-[(4-propylcycloheptyl)amino]acetamide

C13H26N2O — CID 65086398

IUPACN-methyl-2-[(4-propylcycloheptyl)amino]acetamide
SMILESCCCC1CCCC(NCC(=O)NC)CC1
InChIInChI=1S/C13H26N2O/c1-3-5-11-6-4-7-12(9-8-11)15-10-13(16)14-2/h11-12,15H,3-10H2,1-2H3,(H,14,16)
InChIKeyGYZJPGLJYBXNPG-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.07
Rot. Bonds5

About N-methyl-2-[(4-propylcycloheptyl)amino]acetamide

N-methyl-2-[(4-propylcycloheptyl)amino]acetamide (PubChem CID 65086398) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-methyl-2-[(4-propylcycloheptyl)amino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[(4-propylcycloheptyl)amino]acetamide
PubChem CID65086398
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-methyl-2-[(4-propylcycloheptyl)amino]acetamide
SMILESCCCC1CCCC(NCC(=O)NC)CC1
InChIInChI=1S/C13H26N2O/c1-3-5-11-6-4-7-12(9-8-11)15-10-13(16)14-2/h11-12,15H,3-10H2,1-2H3,(H,14,16)
InChIKeyGYZJPGLJYBXNPG-UHFFFAOYSA-N
XLogP2.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(4-propylcycloheptyl)amino]acetamide?
The IUPAC name of N-methyl-2-[(4-propylcycloheptyl)amino]acetamide (CID 65086398) is N-methyl-2-[(4-propylcycloheptyl)amino]acetamide.
What is the SMILES notation for N-methyl-2-[(4-propylcycloheptyl)amino]acetamide?
The canonical SMILES for N-methyl-2-[(4-propylcycloheptyl)amino]acetamide is CCCC1CCCC(NCC(=O)NC)CC1.
What is the InChIKey of N-methyl-2-[(4-propylcycloheptyl)amino]acetamide?
The InChIKey is GYZJPGLJYBXNPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-3-5-11-6-4-7-12(9-8-11)15-10-13(16)14-2/h11-12,15H,3-10H2,1-2H3,(H,14,16).
What are the key properties of N-methyl-2-[(4-propylcycloheptyl)amino]acetamide?
N-methyl-2-[(4-propylcycloheptyl)amino]acetamide has a molecular weight of 226.36 g/mol, XLogP of 2.07, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(4-propylcycloheptyl)amino]acetamide is sourced from PubChem (CID 65086398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).