2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol

C10H18ClNO — CID 109397824

IUPAC2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol
SMILESC=C(Cl)CN(C)CC1CCCC1O
InChIInChI=1S/C10H18ClNO/c1-8(11)6-12(2)7-9-4-3-5-10(9)13/h9-10,13H,1,3-7H2,2H3
InChIKeyVKQQMZGRUHPNOQ-UHFFFAOYSA-N
MW203.71 g/mol
LogP1.83
Rot. Bonds4

About 2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol

2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol (PubChem CID 109397824) has the molecular formula C10H18ClNO and a molecular weight of 203.71 g/mol. Its IUPAC name is 2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol
PubChem CID109397824
Molecular FormulaC10H18ClNO
Molecular Weight203.71 g/mol
Exact Mass203.11
IUPAC Name2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol
SMILESC=C(Cl)CN(C)CC1CCCC1O
InChIInChI=1S/C10H18ClNO/c1-8(11)6-12(2)7-9-4-3-5-10(9)13/h9-10,13H,1,3-7H2,2H3
InChIKeyVKQQMZGRUHPNOQ-UHFFFAOYSA-N
XLogP1.83
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.71
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol (CID 109397824) is 2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol is C=C(Cl)CN(C)CC1CCCC1O.
What is the InChIKey of 2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol?
The InChIKey is VKQQMZGRUHPNOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18ClNO/c1-8(11)6-12(2)7-9-4-3-5-10(9)13/h9-10,13H,1,3-7H2,2H3.
What are the key properties of 2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol?
2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol has a molecular weight of 203.71 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-chloroprop-2-enyl(methyl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 109397824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).