N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride

C11H21ClN2O — CID 130978326

IUPACN-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride
SMILESCC1(C)CNC1C(=O)NC1CCCC1.Cl
InChIInChI=1S/C11H20N2O.ClH/c1-11(2)7-12-9(11)10(14)13-8-5-3-4-6-8;/h8-9,12H,3-7H2,1-2H3,(H,13,14);1H
InChIKeyOVHSFUVQIVKUJT-UHFFFAOYSA-N
MW232.75 g/mol
LogP1.47
Rot. Bonds2

About N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride

N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride (PubChem CID 130978326) has the molecular formula C11H21ClN2O and a molecular weight of 232.75 g/mol. Its IUPAC name is N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride
PubChem CID130978326
Molecular FormulaC11H21ClN2O
Molecular Weight232.75 g/mol
Exact Mass232.13
IUPAC NameN-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride
SMILESCC1(C)CNC1C(=O)NC1CCCC1.Cl
InChIInChI=1S/C11H20N2O.ClH/c1-11(2)7-12-9(11)10(14)13-8-5-3-4-6-8;/h8-9,12H,3-7H2,1-2H3,(H,13,14);1H
InChIKeyOVHSFUVQIVKUJT-UHFFFAOYSA-N
XLogP1.47
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.75
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride?
The IUPAC name of N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride (CID 130978326) is N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride is CC1(C)CNC1C(=O)NC1CCCC1.Cl.
What is the InChIKey of N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride?
The InChIKey is OVHSFUVQIVKUJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O.ClH/c1-11(2)7-12-9(11)10(14)13-8-5-3-4-6-8;/h8-9,12H,3-7H2,1-2H3,(H,13,14);1H.
What are the key properties of N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride?
N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride has a molecular weight of 232.75 g/mol, XLogP of 1.47, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3,3-dimethylazetidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 130978326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).