N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide

C17H28N2O — CID 82765102

IUPACN-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide
SMILESCC1(C(=O)NC2C3CC4CC(C3)CC2C4)CCCC1N
InChIInChI=1S/C17H28N2O/c1-17(4-2-3-14(17)18)16(20)19-15-12-6-10-5-11(8-12)9-13(15)7-10/h10-15H,2-9,18H2,1H3,(H,19,20)
InChIKeyVLKHMAFLOWTMRS-UHFFFAOYSA-N
MW276.42 g/mol
LogP2.44
Rot. Bonds2

About N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide

N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide (PubChem CID 82765102) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide
PubChem CID82765102
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC NameN-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide
SMILESCC1(C(=O)NC2C3CC4CC(C3)CC2C4)CCCC1N
InChIInChI=1S/C17H28N2O/c1-17(4-2-3-14(17)18)16(20)19-15-12-6-10-5-11(8-12)9-13(15)7-10/h10-15H,2-9,18H2,1H3,(H,19,20)
InChIKeyVLKHMAFLOWTMRS-UHFFFAOYSA-N
XLogP2.44
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide?
The IUPAC name of N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide (CID 82765102) is N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide?
The canonical SMILES for N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide is CC1(C(=O)NC2C3CC4CC(C3)CC2C4)CCCC1N.
What is the InChIKey of N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide?
The InChIKey is VLKHMAFLOWTMRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-17(4-2-3-14(17)18)16(20)19-15-12-6-10-5-11(8-12)9-13(15)7-10/h10-15H,2-9,18H2,1H3,(H,19,20).
What are the key properties of N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide?
N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide has a molecular weight of 276.42 g/mol, XLogP of 2.44, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 82765102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).