N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide

C10H20N2O2 — CID 114632490

IUPACN-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide
SMILESCOCCC(=O)NC1CC(N)C1(C)C
InChIInChI=1S/C10H20N2O2/c1-10(2)7(11)6-8(10)12-9(13)4-5-14-3/h7-8H,4-6,11H2,1-3H3,(H,12,13)
InChIKeyPKLZPYQBRNVPBR-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.26
Rot. Bonds4

About N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide

N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide (PubChem CID 114632490) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide
PubChem CID114632490
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide
SMILESCOCCC(=O)NC1CC(N)C1(C)C
InChIInChI=1S/C10H20N2O2/c1-10(2)7(11)6-8(10)12-9(13)4-5-14-3/h7-8H,4-6,11H2,1-3H3,(H,12,13)
InChIKeyPKLZPYQBRNVPBR-UHFFFAOYSA-N
XLogP0.26
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide?
The IUPAC name of N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide (CID 114632490) is N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide?
The canonical SMILES for N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide is COCCC(=O)NC1CC(N)C1(C)C.
What is the InChIKey of N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide?
The InChIKey is PKLZPYQBRNVPBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-10(2)7(11)6-8(10)12-9(13)4-5-14-3/h7-8H,4-6,11H2,1-3H3,(H,12,13).
What are the key properties of N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide?
N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide has a molecular weight of 200.28 g/mol, XLogP of 0.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylcyclobutyl)-3-methoxypropanamide is sourced from PubChem (CID 114632490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).