cyclobutyl(furan-2-yl)methanamine;hydrochloride

C9H14ClNO — CID 86263195

IUPACcyclobutyl(furan-2-yl)methanamine;hydrochloride
SMILESCl.NC(c1ccco1)C1CCC1
InChIInChI=1S/C9H13NO.ClH/c10-9(7-3-1-4-7)8-5-2-6-11-8;/h2,5-7,9H,1,3-4,10H2;1H
InChIKeyQRUVAEGNPURLAE-UHFFFAOYSA-N
MW187.67 g/mol
LogP2.50
Rot. Bonds2

About cyclobutyl(furan-2-yl)methanamine;hydrochloride

cyclobutyl(furan-2-yl)methanamine;hydrochloride (PubChem CID 86263195) has the molecular formula C9H14ClNO and a molecular weight of 187.67 g/mol. Its IUPAC name is cyclobutyl(furan-2-yl)methanamine;hydrochloride.

Molecular Properties

Compound Namecyclobutyl(furan-2-yl)methanamine;hydrochloride
PubChem CID86263195
Molecular FormulaC9H14ClNO
Molecular Weight187.67 g/mol
Exact Mass187.08
IUPAC Namecyclobutyl(furan-2-yl)methanamine;hydrochloride
SMILESCl.NC(c1ccco1)C1CCC1
InChIInChI=1S/C9H13NO.ClH/c10-9(7-3-1-4-7)8-5-2-6-11-8;/h2,5-7,9H,1,3-4,10H2;1H
InChIKeyQRUVAEGNPURLAE-UHFFFAOYSA-N
XLogP2.50
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.67
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(S)-cyclopropyl(furan-2-yl)methanamine
CID 58735829
cyclopropyl(furan-2-yl)methanamine
CID 5013297
furan-2-yl-(2-methylcyclopentyl)methanamine
CID 107177680
(1R,2R)-1,2-bis(furan-2-yl)ethane-1,2-diamine;hydrochloride
CID 156789139
2-amino-3-cyclohexyl-3-(furan-2-yl)propan-1-ol
CID 70050486
2-amino-N-cyclopropyl-2-(furan-2-yl)acetamide;hydrochloride
CID 130608029
2-amino-3-cyclohexyl-1-(furan-2-yl)propan-1-ol
CID 19378615
(1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol
CID 70048188
2-amino-N-cyclopropyl-2-(furan-2-yl)acetamide
CID 83529933
2-cyclopropyl-1-(furan-2-yl)-2-methoxyethanamine
CID 116721918
3,4-dihydro-2H-chromen-4-yl(furan-2-yl)methanamine
CID 63710811
1-[(R)-cyclohexyl(furan-2-yl)methyl]piperazine;dihydrochloride
CID 171294118

Frequently Asked Questions

What is the IUPAC name of cyclobutyl(furan-2-yl)methanamine;hydrochloride?
The IUPAC name of cyclobutyl(furan-2-yl)methanamine;hydrochloride (CID 86263195) is cyclobutyl(furan-2-yl)methanamine;hydrochloride.
What is the SMILES notation for cyclobutyl(furan-2-yl)methanamine;hydrochloride?
The canonical SMILES for cyclobutyl(furan-2-yl)methanamine;hydrochloride is Cl.NC(c1ccco1)C1CCC1.
What is the InChIKey of cyclobutyl(furan-2-yl)methanamine;hydrochloride?
The InChIKey is QRUVAEGNPURLAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO.ClH/c10-9(7-3-1-4-7)8-5-2-6-11-8;/h2,5-7,9H,1,3-4,10H2;1H.
What are the key properties of cyclobutyl(furan-2-yl)methanamine;hydrochloride?
cyclobutyl(furan-2-yl)methanamine;hydrochloride has a molecular weight of 187.67 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl(furan-2-yl)methanamine;hydrochloride is sourced from PubChem (CID 86263195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).