[2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol

C11H20ClNO — CID 106437857

IUPAC[2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol
SMILESCC(=CCl)CNCC1CCCC1CO
InChIInChI=1S/C11H20ClNO/c1-9(5-12)6-13-7-10-3-2-4-11(10)8-14/h5,10-11,13-14H,2-4,6-8H2,1H3
InChIKeyVIWLNRBAEDZOIS-UHFFFAOYSA-N
MW217.74 g/mol
LogP2.13
Rot. Bonds5

About [2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol

[2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol (PubChem CID 106437857) has the molecular formula C11H20ClNO and a molecular weight of 217.74 g/mol. Its IUPAC name is [2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol
PubChem CID106437857
Molecular FormulaC11H20ClNO
Molecular Weight217.74 g/mol
Exact Mass217.12
IUPAC Name[2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol
SMILESCC(=CCl)CNCC1CCCC1CO
InChIInChI=1S/C11H20ClNO/c1-9(5-12)6-13-7-10-3-2-4-11(10)8-14/h5,10-11,13-14H,2-4,6-8H2,1H3
InChIKeyVIWLNRBAEDZOIS-UHFFFAOYSA-N
XLogP2.13
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.74
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol
CID 106438361
3-chloro-N-(cyclopropylmethyl)-2-methylprop-2-en-1-amine
CID 106437274
[2-[(2-methylidenebutylamino)methyl]cyclopentyl]methanol
CID 66046903
3-chloro-2-methyl-N-(thiolan-2-ylmethyl)prop-2-en-1-amine
CID 106437912
3-chloro-2-methyl-N-(thian-2-ylmethyl)prop-2-en-1-amine
CID 106437913
N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide
CID 107529594
5-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]pyrrolidin-2-one
CID 106437797
4-[[2-(hydroxymethyl)cyclohexyl]methylamino]-2-methylbut-2-enoic acid
CID 103255243
N-(3-chloro-2-methylprop-2-enyl)cyclopentanamine
CID 106437272
[2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol
CID 106452162
3-[[2-(hydroxymethyl)cyclohexyl]methylamino]-2,2-dimethylpropan-1-ol
CID 81410855
N-(3-chloro-2-methylprop-2-enyl)cycloheptanamine
CID 106437444

Frequently Asked Questions

What is the IUPAC name of [2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol?
The IUPAC name of [2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol (CID 106437857) is [2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol is CC(=CCl)CNCC1CCCC1CO.
What is the InChIKey of [2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol?
The InChIKey is VIWLNRBAEDZOIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20ClNO/c1-9(5-12)6-13-7-10-3-2-4-11(10)8-14/h5,10-11,13-14H,2-4,6-8H2,1H3.
What are the key properties of [2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol?
[2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol has a molecular weight of 217.74 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 106437857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).