N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine

C10H18ClN — CID 115702589

IUPACN-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine
SMILESC=C(Cl)CNC1CCC(CC)C1
InChIInChI=1S/C10H18ClN/c1-3-9-4-5-10(6-9)12-7-8(2)11/h9-10,12H,2-7H2,1H3
InChIKeyBQLBAEMJJVBXDK-UHFFFAOYSA-N
MW187.71 g/mol
LogP2.91
Rot. Bonds4

About N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine

N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine (PubChem CID 115702589) has the molecular formula C10H18ClN and a molecular weight of 187.71 g/mol. Its IUPAC name is N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine.

Molecular Properties

Compound NameN-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine
PubChem CID115702589
Molecular FormulaC10H18ClN
Molecular Weight187.71 g/mol
Exact Mass187.11
IUPAC NameN-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine
SMILESC=C(Cl)CNC1CCC(CC)C1
InChIInChI=1S/C10H18ClN/c1-3-9-4-5-10(6-9)12-7-8(2)11/h9-10,12H,2-7H2,1H3
InChIKeyBQLBAEMJJVBXDK-UHFFFAOYSA-N
XLogP2.91
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 ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-chloroprop-2-enyl)-3-ethylcyclohexan-1-amine
CID 64741238
3-ethyl-N-(2-methylidenebutyl)cyclohexan-1-amine
CID 66044278
(3R)-3-ethyl-N-methylcyclopentan-1-amine
CID 143473182
2-[[(3-ethylcyclohexyl)amino]methyl]prop-2-enoic acid
CID 103253788
ethyl 4-(2-chloroprop-2-enylamino)cyclohexane-1-carboxylate
CID 115924325
N-cyclohexyl-2-[(3-ethylcyclohexyl)amino]acetamide
CID 64742794
1-[[(3-ethylcyclopentyl)amino]methyl]cyclopentan-1-ol
CID 65105950
N-(2-cyclobutylethyl)-3-ethylcyclopentan-1-amine
CID 115690186
4-(2-chloroprop-2-enylamino)cyclohexane-1-carboxylic acid
CID 60808095
N-[[4-ethyl-2-(2-methylidenebutyl)cyclohexyl]methyl]cyclopropanamine
CID 81029583
N-[2-[(3-ethylcyclopentyl)amino]ethyl]cyclopropanecarboxamide
CID 115651444
N-[(1-cyclopropylcyclopropyl)methyl]-3-ethylcyclopentan-1-amine
CID 115757828

Frequently Asked Questions

What is the IUPAC name of N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine?
The IUPAC name of N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine (CID 115702589) is N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine.
What is the SMILES notation for N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine?
The canonical SMILES for N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine is C=C(Cl)CNC1CCC(CC)C1.
What is the InChIKey of N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine?
The InChIKey is BQLBAEMJJVBXDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18ClN/c1-3-9-4-5-10(6-9)12-7-8(2)11/h9-10,12H,2-7H2,1H3.
What are the key properties of N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine?
N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine has a molecular weight of 187.71 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloroprop-2-enyl)-3-ethylcyclopentan-1-amine is sourced from PubChem (CID 115702589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).