5-(furan-2-ylmethylamino)pentan-2-ol

C10H17NO2 — CID 79200814

IUPAC5-(furan-2-ylmethylamino)pentan-2-ol
SMILESCC(O)CCCNCc1ccco1
InChIInChI=1S/C10H17NO2/c1-9(12)4-2-6-11-8-10-5-3-7-13-10/h3,5,7,9,11-12H,2,4,6,8H2,1H3
InChIKeyQIQPICZRZXVJFJ-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.53
Rot. Bonds6

About 5-(furan-2-ylmethylamino)pentan-2-ol

5-(furan-2-ylmethylamino)pentan-2-ol (PubChem CID 79200814) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 5-(furan-2-ylmethylamino)pentan-2-ol.

Molecular Properties

Compound Name5-(furan-2-ylmethylamino)pentan-2-ol
PubChem CID79200814
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name5-(furan-2-ylmethylamino)pentan-2-ol
SMILESCC(O)CCCNCc1ccco1
InChIInChI=1S/C10H17NO2/c1-9(12)4-2-6-11-8-10-5-3-7-13-10/h3,5,7,9,11-12H,2,4,6,8H2,1H3
InChIKeyQIQPICZRZXVJFJ-UHFFFAOYSA-N
XLogP1.53
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-(furan-2-ylmethylamino)-2-methylpentan-1-ol
CID 103859513
N,N'-bis(furan-2-ylmethyl)pentane-1,5-diamine
CID 170781680
(3S)-1-N-(furan-2-ylmethyl)butane-1,3-diamine
CID 66594455
N-(furan-2-ylmethyl)-3-propan-2-yloxypropan-1-amine
CID 3155080
N'-(furan-2-ylmethyl)-2-methylbutane-1,4-diamine
CID 79001737
5-[[5-(hydroxymethyl)furan-2-yl]methylamino]pentan-2-ol
CID 107267638
5-[(5-chlorofuran-2-yl)methylamino]pentan-2-ol
CID 107267883
methyl 4-(furan-2-ylmethylamino)butanoate
CID 30403384
5-(furan-2-ylmethylamino)-4,4-dimethylpentan-2-ol
CID 111467857
6-(furan-2-ylmethylamino)-4-methylhexanoic acid
CID 65290191
N'-(furan-2-ylmethyl)hexane-1,6-diamine
CID 61150200
3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide
CID 60765510

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-ylmethylamino)pentan-2-ol?
The IUPAC name of 5-(furan-2-ylmethylamino)pentan-2-ol (CID 79200814) is 5-(furan-2-ylmethylamino)pentan-2-ol.
What is the SMILES notation for 5-(furan-2-ylmethylamino)pentan-2-ol?
The canonical SMILES for 5-(furan-2-ylmethylamino)pentan-2-ol is CC(O)CCCNCc1ccco1.
What is the InChIKey of 5-(furan-2-ylmethylamino)pentan-2-ol?
The InChIKey is QIQPICZRZXVJFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-9(12)4-2-6-11-8-10-5-3-7-13-10/h3,5,7,9,11-12H,2,4,6,8H2,1H3.
What are the key properties of 5-(furan-2-ylmethylamino)pentan-2-ol?
5-(furan-2-ylmethylamino)pentan-2-ol has a molecular weight of 183.25 g/mol, XLogP of 1.53, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-ylmethylamino)pentan-2-ol is sourced from PubChem (CID 79200814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).