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

C10H18ClNO — CID 106438361

IUPAC[2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol
SMILESCC(=CCl)CNC1CCCC1CO
InChIInChI=1S/C10H18ClNO/c1-8(5-11)6-12-10-4-2-3-9(10)7-13/h5,9-10,12-13H,2-4,6-7H2,1H3
InChIKeyKTTHPTBYTXTEMS-UHFFFAOYSA-N
MW203.71 g/mol
LogP1.88
Rot. Bonds4

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

[2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol (PubChem CID 106438361) has the molecular formula C10H18ClNO and a molecular weight of 203.71 g/mol. Its IUPAC name is [2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol
PubChem CID106438361
Molecular FormulaC10H18ClNO
Molecular Weight203.71 g/mol
Exact Mass203.11
IUPAC Name[2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol
SMILESCC(=CCl)CNC1CCCC1CO
InChIInChI=1S/C10H18ClNO/c1-8(5-11)6-12-10-4-2-3-9(10)7-13/h5,9-10,12-13H,2-4,6-7H2,1H3
InChIKeyKTTHPTBYTXTEMS-UHFFFAOYSA-N
XLogP1.88
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.71
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(2,3-dichloroprop-2-enylamino)cyclopentyl]methanol
CID 106360754
4-[[2-(hydroxymethyl)cyclopentyl]amino]-3-methylbut-2-enoic acid
CID 106362470
[2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol
CID 106437857
[2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol
CID 106360609
2-[[(1R,2S)-2-(hydroxymethyl)cyclopentyl]amino]ethanol
CID 131230127
[(1S)-2-(methylamino)cyclopentyl]methanol
CID 123545278
4-[[2-(hydroxymethyl)cyclohexyl]amino]-2-methylbut-2-enoic acid
CID 106362516
N-(2,3-dichloroprop-2-enyl)-2-ethylcyclohexan-1-amine
CID 79167923
(E)-4-[[2-(hydroxymethyl)cyclopentyl]amino]but-2-enoic acid
CID 106362463
N-cyclohexyl-2-[[2-(hydroxymethyl)cyclohexyl]amino]acetamide
CID 104934417
2-[[[2-(hydroxymethyl)cyclopentyl]amino]methyl]-2-methylpropane-1,3-diol
CID 106360962
3-[[2-(hydroxymethyl)cyclopentyl]amino]-2-methylpropan-1-ol
CID 106360784

Frequently Asked Questions

What is the IUPAC name of [2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol?
The IUPAC name of [2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol (CID 106438361) is [2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol.
What is the SMILES notation for [2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol?
The canonical SMILES for [2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol is CC(=CCl)CNC1CCCC1CO.
What is the InChIKey of [2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol?
The InChIKey is KTTHPTBYTXTEMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18ClNO/c1-8(5-11)6-12-10-4-2-3-9(10)7-13/h5,9-10,12-13H,2-4,6-7H2,1H3.
What are the key properties of [2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol?
[2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol has a molecular weight of 203.71 g/mol, XLogP of 1.88, 4 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]cyclopentyl]methanol is sourced from PubChem (CID 106438361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).