N-(2-chloro-2-cyclopropylethyl)cyclopentanamine

C10H18ClN — CID 82937257

IUPACN-(2-chloro-2-cyclopropylethyl)cyclopentanamine
SMILESClC(CNC1CCCC1)C1CC1
InChIInChI=1S/C10H18ClN/c11-10(8-5-6-8)7-12-9-3-1-2-4-9/h8-10,12H,1-7H2
InChIKeyCOLAOCYCWFYFGK-UHFFFAOYSA-N
MW187.71 g/mol
LogP2.54
Rot. Bonds4

About N-(2-chloro-2-cyclopropylethyl)cyclopentanamine

N-(2-chloro-2-cyclopropylethyl)cyclopentanamine (PubChem CID 82937257) has the molecular formula C10H18ClN and a molecular weight of 187.71 g/mol. Its IUPAC name is N-(2-chloro-2-cyclopropylethyl)cyclopentanamine.

Molecular Properties

Compound NameN-(2-chloro-2-cyclopropylethyl)cyclopentanamine
PubChem CID82937257
Molecular FormulaC10H18ClN
Molecular Weight187.71 g/mol
Exact Mass187.11
IUPAC NameN-(2-chloro-2-cyclopropylethyl)cyclopentanamine
SMILESClC(CNC1CCCC1)C1CC1
InChIInChI=1S/C10H18ClN/c11-10(8-5-6-8)7-12-9-3-1-2-4-9/h8-10,12H,1-7H2
InChIKeyCOLAOCYCWFYFGK-UHFFFAOYSA-N
XLogP2.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.71
LogP ≤ 52.54
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-cyclopropylpropyl)cyclooctanamine
CID 115592679
2-chloro-N-(cyclopentylmethyl)-2-cyclopropylethanamine
CID 65030391
ethane;N-(2-methylpropyl)cyclopentanamine
CID 156893756
methanol;N-(2-methylpropyl)cyclopentanamine
CID 166557930
N-(3-chlorobutyl)cyclopentanamine
CID 82936490
N'-cycloheptyl-1-cyclopropyl-N,N-dimethylethane-1,2-diamine;hydrochloride
CID 115584803
1-chloro-3-(cyclooctylamino)propan-2-ol
CID 10443428
N-[(2S)-2,3-dimethylbutyl]cyclopentanamine
CID 59085010
1-(cyclooctylamino)propan-2-ol
CID 20539535
1-(cycloheptylamino)propan-2-ol
CID 43392225
N-(2-methylbutyl)cyclopentanamine
CID 43200714
methyl 2-chloro-3-(cyclohexylamino)propanoate
CID 103845864

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-2-cyclopropylethyl)cyclopentanamine?
The IUPAC name of N-(2-chloro-2-cyclopropylethyl)cyclopentanamine (CID 82937257) is N-(2-chloro-2-cyclopropylethyl)cyclopentanamine.
What is the SMILES notation for N-(2-chloro-2-cyclopropylethyl)cyclopentanamine?
The canonical SMILES for N-(2-chloro-2-cyclopropylethyl)cyclopentanamine is ClC(CNC1CCCC1)C1CC1.
What is the InChIKey of N-(2-chloro-2-cyclopropylethyl)cyclopentanamine?
The InChIKey is COLAOCYCWFYFGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18ClN/c11-10(8-5-6-8)7-12-9-3-1-2-4-9/h8-10,12H,1-7H2.
What are the key properties of N-(2-chloro-2-cyclopropylethyl)cyclopentanamine?
N-(2-chloro-2-cyclopropylethyl)cyclopentanamine has a molecular weight of 187.71 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-2-cyclopropylethyl)cyclopentanamine is sourced from PubChem (CID 82937257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).