[1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride

C10H20ClNO — CID 122154863

IUPAC[1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride
SMILESCC(C)C(N)C1(CO)CC=CC1.Cl
InChIInChI=1S/C10H19NO.ClH/c1-8(2)9(11)10(7-12)5-3-4-6-10;/h3-4,8-9,12H,5-7,11H2,1-2H3;1H
InChIKeyFRTHQTYJHKYOSH-UHFFFAOYSA-N
MW205.73 g/mol
LogP1.72
Rot. Bonds3

About [1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride

[1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride (PubChem CID 122154863) has the molecular formula C10H20ClNO and a molecular weight of 205.73 g/mol. Its IUPAC name is [1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride.

Molecular Properties

Compound Name[1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride
PubChem CID122154863
Molecular FormulaC10H20ClNO
Molecular Weight205.73 g/mol
Exact Mass205.12
IUPAC Name[1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride
SMILESCC(C)C(N)C1(CO)CC=CC1.Cl
InChIInChI=1S/C10H19NO.ClH/c1-8(2)9(11)10(7-12)5-3-4-6-10;/h3-4,8-9,12H,5-7,11H2,1-2H3;1H
InChIKeyFRTHQTYJHKYOSH-UHFFFAOYSA-N
XLogP1.72
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.73
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[1-[1-(hydroxymethyl)cyclopent-3-en-1-yl]-2-methylpropyl]acetamide
CID 167743406
[1-(1-aminoethyl)cyclobutyl]methanol;hydrochloride
CID 155893033
1-(1-amino-2-methylpropyl)cyclopentan-1-ol
CID 18373867
[1-(3-methylbutan-2-yl)cyclohex-3-en-1-yl]methanamine
CID 130646430
(1R)-1-[(2R)-2-aminopropyl]cyclohexa-2,4-dien-1-ol
CID 6451280
(1S,2S)-1-amino-1-(1-chlorocyclohexa-2,4-dien-1-yl)butan-2-ol
CID 160883545
4-ethyl-4-propan-2-ylcyclohexene
CID 23385010
[1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride
CID 155893479
(2S)-2-amino-N-[1-(hydroxymethyl)cyclobutyl]-3-methylbutanamide
CID 104873901
ethane-1,1-diamine;ethane-1,2-diol
CID 88638607
(2S)-2-amino-3-methylbutan-1-ol;2-amino-3-methylbutan-1-ol
CID 87115699
(3S)-2-methylpentan-3-amine;hydrochloride
CID 11651162

Frequently Asked Questions

What is the IUPAC name of [1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride?
The IUPAC name of [1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride (CID 122154863) is [1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride.
What is the SMILES notation for [1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride?
The canonical SMILES for [1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride is CC(C)C(N)C1(CO)CC=CC1.Cl.
What is the InChIKey of [1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride?
The InChIKey is FRTHQTYJHKYOSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO.ClH/c1-8(2)9(11)10(7-12)5-3-4-6-10;/h3-4,8-9,12H,5-7,11H2,1-2H3;1H.
What are the key properties of [1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride?
[1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride has a molecular weight of 205.73 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-amino-2-methylpropyl)cyclopent-3-en-1-yl]methanol;hydrochloride is sourced from PubChem (CID 122154863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).