[2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol

C10H19NO — CID 106360609

IUPAC[2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol
SMILESC/C=C/CNC1CCCC1CO
InChIInChI=1S/C10H19NO/c1-2-3-7-11-10-6-4-5-9(10)8-12/h2-3,9-12H,4-8H2,1H3/b3-2+
InChIKeyNRTUWIWGVNGRKG-NSCUHMNNSA-N
MW169.27 g/mol
LogP1.31
Rot. Bonds4

About [2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol

[2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol (PubChem CID 106360609) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is [2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol
PubChem CID106360609
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name[2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol
SMILESC/C=C/CNC1CCCC1CO
InChIInChI=1S/C10H19NO/c1-2-3-7-11-10-6-4-5-9(10)8-12/h2-3,9-12H,4-8H2,1H3/b3-2+
InChIKeyNRTUWIWGVNGRKG-NSCUHMNNSA-N
XLogP1.31
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze [2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-4-[[2-(hydroxymethyl)cyclopentyl]amino]but-2-enoic acid
CID 106362463
[2-[(3-chloro-2-methylprop-2-enyl)amino]cyclopentyl]methanol
CID 106438361
2-[[(1R,2S)-2-(hydroxymethyl)cyclopentyl]amino]ethanol
CID 131230127
2-ethyl-4-[[2-(hydroxymethyl)cyclopentyl]amino]but-2-enoic acid
CID 106362430
[2-(2,3-dichloroprop-2-enylamino)cyclopentyl]methanol
CID 106360754
[(1S)-2-(methylamino)cyclopentyl]methanol
CID 123545278
4-[[2-(hydroxymethyl)cyclohexyl]amino]-2-methylbut-2-enoic acid
CID 106362516
4-[[2-(hydroxymethyl)cyclopentyl]amino]-3-methylbut-2-enoic acid
CID 106362470
3-[[2-(hydroxymethyl)cyclopentyl]amino]-2-methylpropan-1-ol
CID 106360784
2-[[[2-(hydroxymethyl)cyclopentyl]amino]methyl]-2-methylpropane-1,3-diol
CID 106360962
2-ethyl-N-(3-methylbut-2-enyl)cyclopentan-1-amine
CID 103522734
[(1R,2R)-2-(prop-2-ynylamino)cyclohexyl]methanol
CID 130608522

Frequently Asked Questions

What is the IUPAC name of [2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol?
The IUPAC name of [2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol (CID 106360609) is [2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol.
What is the SMILES notation for [2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol?
The canonical SMILES for [2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol is C/C=C/CNC1CCCC1CO.
What is the InChIKey of [2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol?
The InChIKey is NRTUWIWGVNGRKG-NSCUHMNNSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-3-7-11-10-6-4-5-9(10)8-12/h2-3,9-12H,4-8H2,1H3/b3-2+.
What are the key properties of [2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol?
[2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol has a molecular weight of 169.27 g/mol, XLogP of 1.31, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[(E)-but-2-enyl]amino]cyclopentyl]methanol is sourced from PubChem (CID 106360609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).