N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide

C15H28N2O — CID 81482446

IUPACN-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide
SMILESCC(C(=O)NCCNC1CCCCCC1)C1CC1
InChIInChI=1S/C15H28N2O/c1-12(13-8-9-13)15(18)17-11-10-16-14-6-4-2-3-5-7-14/h12-14,16H,2-11H2,1H3,(H,17,18)
InChIKeyLVSVEQNWOZHCAV-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.46
Rot. Bonds6

About N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide

N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide (PubChem CID 81482446) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide.

Molecular Properties

Compound NameN-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide
PubChem CID81482446
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide
SMILESCC(C(=O)NCCNC1CCCCCC1)C1CC1
InChIInChI=1S/C15H28N2O/c1-12(13-8-9-13)15(18)17-11-10-16-14-6-4-2-3-5-7-14/h12-14,16H,2-11H2,1H3,(H,17,18)
InChIKeyLVSVEQNWOZHCAV-UHFFFAOYSA-N
XLogP2.46
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(cyclododecylamino)ethyl]-2-methylpropanamide
CID 28552099
N-[2-(cyclohexylamino)ethyl]-2-methylpropanamide
CID 28651344
N-[2-(cyclononylamino)ethyl]acetamide
CID 154969023
N-butyl-2-cyclopentylpropanamide
CID 173178636
2-acetamido-N-[2-(cycloheptylamino)ethyl]-2-cyclopentylacetamide;hydrochloride
CID 119619470
methyl N-[2-(cycloheptylamino)ethyl]carbamate
CID 115306508
N-(2-bromoethyl)-2-cyclopropylpropanamide
CID 83154146
2-cyclopropyl-N-[2-(propylamino)ethyl]propanamide
CID 115563513
2-cyclopropyl-N-(3-hydroxypropyl)propanamide
CID 81449535
N-[2-(cycloheptylamino)ethyl]-2-pyrazol-1-ylpropanamide
CID 81424644
2-cyclohexyl-N-methylpropanamide;ethane
CID 143855673
N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)propanamide;hydrochloride
CID 119620567

Frequently Asked Questions

What is the IUPAC name of N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide?
The IUPAC name of N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide (CID 81482446) is N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide.
What is the SMILES notation for N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide?
The canonical SMILES for N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide is CC(C(=O)NCCNC1CCCCCC1)C1CC1.
What is the InChIKey of N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide?
The InChIKey is LVSVEQNWOZHCAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-12(13-8-9-13)15(18)17-11-10-16-14-6-4-2-3-5-7-14/h12-14,16H,2-11H2,1H3,(H,17,18).
What are the key properties of N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide?
N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide has a molecular weight of 252.40 g/mol, XLogP of 2.46, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide is sourced from PubChem (CID 81482446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).