N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide

C13H24N2O — CID 107184778

IUPACN-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide
SMILESCC1CCCC1C(=O)NC1CC(N)C1(C)C
InChIInChI=1S/C13H24N2O/c1-8-5-4-6-9(8)12(16)15-11-7-10(14)13(11,2)3/h8-11H,4-7,14H2,1-3H3,(H,15,16)
InChIKeyMWAWOONXCPVABR-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.66
Rot. Bonds2

About N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide

N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide (PubChem CID 107184778) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide
PubChem CID107184778
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide
SMILESCC1CCCC1C(=O)NC1CC(N)C1(C)C
InChIInChI=1S/C13H24N2O/c1-8-5-4-6-9(8)12(16)15-11-7-10(14)13(11,2)3/h8-11H,4-7,14H2,1-3H3,(H,15,16)
InChIKeyMWAWOONXCPVABR-UHFFFAOYSA-N
XLogP1.66
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide?
The IUPAC name of N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide (CID 107184778) is N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide?
The canonical SMILES for N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide is CC1CCCC1C(=O)NC1CC(N)C1(C)C.
What is the InChIKey of N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide?
The InChIKey is MWAWOONXCPVABR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-8-5-4-6-9(8)12(16)15-11-7-10(14)13(11,2)3/h8-11H,4-7,14H2,1-3H3,(H,15,16).
What are the key properties of N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide?
N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide has a molecular weight of 224.35 g/mol, XLogP of 1.66, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylcyclobutyl)-2-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 107184778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).