N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide

C11H18ClNO — CID 106366126

IUPACN-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NC1CCCC1CCl
InChIInChI=1S/C11H18ClNO/c1-7-5-9(7)11(14)13-10-4-2-3-8(10)6-12/h7-10H,2-6H2,1H3,(H,13,14)
InChIKeyLMOLGRHSPPNOED-UHFFFAOYSA-N
MW215.72 g/mol
LogP2.17
Rot. Bonds3

About N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide

N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide (PubChem CID 106366126) has the molecular formula C11H18ClNO and a molecular weight of 215.72 g/mol. Its IUPAC name is N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide
PubChem CID106366126
Molecular FormulaC11H18ClNO
Molecular Weight215.72 g/mol
Exact Mass215.11
IUPAC NameN-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NC1CCCC1CCl
InChIInChI=1S/C11H18ClNO/c1-7-5-9(7)11(14)13-10-4-2-3-8(10)6-12/h7-10H,2-6H2,1H3,(H,13,14)
InChIKeyLMOLGRHSPPNOED-UHFFFAOYSA-N
XLogP2.17
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.72
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(chloromethyl)cyclopentyl]-2-methyloxolane-3-carboxamide
CID 106365998
cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide
CID 124840040
N-[2-(chloromethyl)cyclohexyl]cyclobutanecarboxamide
CID 106366933
N-[2-(chloromethyl)cyclopentyl]cycloheptanecarboxamide
CID 106366097
2-methyl-N-(2-methylcyclohexyl)cyclopropane-1-carboxamide
CID 4084655
N-[2-(chloromethyl)cyclopentyl]-2,4,5-trimethyloxolane-3-carboxamide
CID 106365810
N-[2-(chloromethyl)cyclopentyl]butanamide
CID 106365880
2-[[2-(hydroxymethyl)cyclopentyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 106359251
trans-(1R,2S)-2-(aminomethyl)-N-(2-methylcyclopropyl)cyclopentane-1-carboxamide
CID 130760150
N-[2-(chloromethyl)cyclohexyl]-2-methylpropanamide
CID 106366671
N-[2-(chloromethyl)cyclopentyl]-2-cyclopropylacetamide
CID 106365797
N-[2-(chloromethyl)cyclopentyl]-1-methylcyclopentane-1-carboxamide
CID 106365855

Frequently Asked Questions

What is the IUPAC name of N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide (CID 106366126) is N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide is CC1CC1C(=O)NC1CCCC1CCl.
What is the InChIKey of N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide?
The InChIKey is LMOLGRHSPPNOED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18ClNO/c1-7-5-9(7)11(14)13-10-4-2-3-8(10)6-12/h7-10H,2-6H2,1H3,(H,13,14).
What are the key properties of N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide?
N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide has a molecular weight of 215.72 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 106366126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).