N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine

C9H16ClN — CID 106437272

IUPACN-(3-chloro-2-methylprop-2-enyl)cyclopentanamine
SMILESCC(=CCl)CNC1CCCC1
InChIInChI=1S/C9H16ClN/c1-8(6-10)7-11-9-4-2-3-5-9/h6,9,11H,2-5,7H2,1H3
InChIKeyGZICFQOHZRXMPG-UHFFFAOYSA-N
MW173.69 g/mol
LogP2.66
Rot. Bonds3

About N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine

N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine (PubChem CID 106437272) has the molecular formula C9H16ClN and a molecular weight of 173.69 g/mol. Its IUPAC name is N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine.

Molecular Properties

Compound NameN-(3-chloro-2-methylprop-2-enyl)cyclopentanamine
PubChem CID106437272
Molecular FormulaC9H16ClN
Molecular Weight173.69 g/mol
Exact Mass173.10
IUPAC NameN-(3-chloro-2-methylprop-2-enyl)cyclopentanamine
SMILESCC(=CCl)CNC1CCCC1
InChIInChI=1S/C9H16ClN/c1-8(6-10)7-11-9-4-2-3-5-9/h6,9,11H,2-5,7H2,1H3
InChIKeyGZICFQOHZRXMPG-UHFFFAOYSA-N
XLogP2.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.69
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-chloro-2-methylprop-2-enyl)cycloheptanamine
CID 106437444
N-(2,3-dichloroprop-2-enyl)cyclopentanamine
CID 79167999
N-(3-chloro-2-methylprop-2-enyl)-1-methylsulfonylpiperidin-4-amine
CID 106437494
N-(3-chloro-2-methylprop-2-enyl)-1-methylpyrrolidin-3-amine
CID 106437575
N-(3-chloro-2-methylprop-2-enyl)-3-methoxycyclopentan-1-amine
CID 106438266
N-(3-chloro-2-methylprop-2-enyl)-2-methyloxan-4-amine
CID 106438247
3-chloro-N-[(1R)-1-cyclohexylethyl]-2-methylprop-2-en-1-amine
CID 106437955
1-(cyclobutylamino)propan-2-one
CID 21335373
[(5-methylcyclononyl)amino]methanol
CID 155469542
N-(3-methyl-2-methylidenebut-3-enyl)cyclohexanamine
CID 24974469
N-[(E)-2-ethylbut-2-enyl]cyclohexanamine
CID 134926768
3-chloro-2-methyl-N-(thian-2-ylmethyl)prop-2-en-1-amine
CID 106437913

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine?
The IUPAC name of N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine (CID 106437272) is N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine.
What is the SMILES notation for N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine?
The canonical SMILES for N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine is CC(=CCl)CNC1CCCC1.
What is the InChIKey of N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine?
The InChIKey is GZICFQOHZRXMPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16ClN/c1-8(6-10)7-11-9-4-2-3-5-9/h6,9,11H,2-5,7H2,1H3.
What are the key properties of N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine?
N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine has a molecular weight of 173.69 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine is sourced from PubChem (CID 106437272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).