N-(2,3-dichloroprop-2-enyl)cyclopentanamine

C8H13Cl2N — CID 79167999

IUPACN-(2,3-dichloroprop-2-enyl)cyclopentanamine
SMILESClC=C(Cl)CNC1CCCC1
InChIInChI=1S/C8H13Cl2N/c9-5-7(10)6-11-8-3-1-2-4-8/h5,8,11H,1-4,6H2
InChIKeyYYDQQMYVSSXALR-UHFFFAOYSA-N
MW194.10 g/mol
LogP2.84
Rot. Bonds3

About N-(2,3-dichloroprop-2-enyl)cyclopentanamine

N-(2,3-dichloroprop-2-enyl)cyclopentanamine (PubChem CID 79167999) has the molecular formula C8H13Cl2N and a molecular weight of 194.10 g/mol. Its IUPAC name is N-(2,3-dichloroprop-2-enyl)cyclopentanamine.

Molecular Properties

Compound NameN-(2,3-dichloroprop-2-enyl)cyclopentanamine
PubChem CID79167999
Molecular FormulaC8H13Cl2N
Molecular Weight194.10 g/mol
Exact Mass193.04
IUPAC NameN-(2,3-dichloroprop-2-enyl)cyclopentanamine
SMILESClC=C(Cl)CNC1CCCC1
InChIInChI=1S/C8H13Cl2N/c9-5-7(10)6-11-8-3-1-2-4-8/h5,8,11H,1-4,6H2
InChIKeyYYDQQMYVSSXALR-UHFFFAOYSA-N
XLogP2.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.10
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,3-dichloroprop-2-enyl)-3-methylcyclohexan-1-amine
CID 79167631
N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine
CID 106437272
N-(3-chloro-2-methylprop-2-enyl)cycloheptanamine
CID 106437444
N-(2,3-dichloroprop-2-enyl)-2-ethylcyclohexan-1-amine
CID 79167923
[2-(2,3-dichloroprop-2-enylamino)cyclopentyl]methanol
CID 106360754
1-(cyclopentylamino)but-3-en-2-one
CID 116559036
2-(cyclooctylamino)-N-methylacetamide
CID 28575796
[(5-methylcyclononyl)amino]methanol
CID 155469542
N-[(E)-2-ethylbut-2-enyl]cyclohexanamine
CID 134926768
2-[[2-(cyclopentylamino)acetyl]amino]acetic acid
CID 61158187
2-(cyclohexylamino)acetamide
CID 13444045
N-cyclohexyl-2-(thian-4-ylamino)acetamide
CID 115621808

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichloroprop-2-enyl)cyclopentanamine?
The IUPAC name of N-(2,3-dichloroprop-2-enyl)cyclopentanamine (CID 79167999) is N-(2,3-dichloroprop-2-enyl)cyclopentanamine.
What is the SMILES notation for N-(2,3-dichloroprop-2-enyl)cyclopentanamine?
The canonical SMILES for N-(2,3-dichloroprop-2-enyl)cyclopentanamine is ClC=C(Cl)CNC1CCCC1.
What is the InChIKey of N-(2,3-dichloroprop-2-enyl)cyclopentanamine?
The InChIKey is YYDQQMYVSSXALR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13Cl2N/c9-5-7(10)6-11-8-3-1-2-4-8/h5,8,11H,1-4,6H2.
What are the key properties of N-(2,3-dichloroprop-2-enyl)cyclopentanamine?
N-(2,3-dichloroprop-2-enyl)cyclopentanamine has a molecular weight of 194.10 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichloroprop-2-enyl)cyclopentanamine is sourced from PubChem (CID 79167999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).