[5-[(dipropylamino)methyl]furan-2-yl]methanol

C12H21NO2 — CID 115879634

IUPAC[5-[(dipropylamino)methyl]furan-2-yl]methanol
SMILESCCCN(CCC)Cc1ccc(CO)o1
InChIInChI=1S/C12H21NO2/c1-3-7-13(8-4-2)9-11-5-6-12(10-14)15-11/h5-6,14H,3-4,7-10H2,1-2H3
InChIKeyOAMGZPKEAWZYFA-UHFFFAOYSA-N
MW211.31 g/mol
LogP2.39
Rot. Bonds7

About [5-[(dipropylamino)methyl]furan-2-yl]methanol

[5-[(dipropylamino)methyl]furan-2-yl]methanol (PubChem CID 115879634) has the molecular formula C12H21NO2 and a molecular weight of 211.31 g/mol. Its IUPAC name is [5-[(dipropylamino)methyl]furan-2-yl]methanol.

Molecular Properties

Compound Name[5-[(dipropylamino)methyl]furan-2-yl]methanol
PubChem CID115879634
Molecular FormulaC12H21NO2
Molecular Weight211.31 g/mol
Exact Mass211.16
IUPAC Name[5-[(dipropylamino)methyl]furan-2-yl]methanol
SMILESCCCN(CCC)Cc1ccc(CO)o1
InChIInChI=1S/C12H21NO2/c1-3-7-13(8-4-2)9-11-5-6-12(10-14)15-11/h5-6,14H,3-4,7-10H2,1-2H3
InChIKeyOAMGZPKEAWZYFA-UHFFFAOYSA-N
XLogP2.39
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-[[propyl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methanol
CID 112548849
[5-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]furan-2-yl]methanol
CID 112548864
[5-[[ethyl(2-methylprop-2-enyl)amino]methyl]furan-2-yl]methanol
CID 115879804
2-[[5-(hydroxymethyl)furan-2-yl]methyl-propan-2-ylamino]ethanol
CID 115880076
methyl 2-[(5-bromofuran-2-yl)methyl-propylamino]acetate
CID 62012332
N-[[5-(aminomethyl)furan-2-yl]methyl]-N-(cyclopropylmethyl)propan-1-amine
CID 62430054
N-[[5-(methylaminomethyl)furan-2-yl]methyl]-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 55073626
5-[(dipropylamino)methyl]-3-methylfuran-2-carboxylic acid
CID 43621043
5-[[butyl(2-carboxyethyl)amino]methyl]furan-2-carboxylic acid
CID 82330538
tert-butyl N-ethyl-N-[[5-(hydroxymethyl)furan-2-yl]methyl]carbamate
CID 71262900
2-[[5-(diethylaminomethyl)furan-2-carbonyl]-propylamino]acetic acid
CID 61013161
[5-(hydroxymethyl)furan-2-yl]methanol;bis(octanoic acid)
CID 118471769

Frequently Asked Questions

What is the IUPAC name of [5-[(dipropylamino)methyl]furan-2-yl]methanol?
The IUPAC name of [5-[(dipropylamino)methyl]furan-2-yl]methanol (CID 115879634) is [5-[(dipropylamino)methyl]furan-2-yl]methanol.
What is the SMILES notation for [5-[(dipropylamino)methyl]furan-2-yl]methanol?
The canonical SMILES for [5-[(dipropylamino)methyl]furan-2-yl]methanol is CCCN(CCC)Cc1ccc(CO)o1.
What is the InChIKey of [5-[(dipropylamino)methyl]furan-2-yl]methanol?
The InChIKey is OAMGZPKEAWZYFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c1-3-7-13(8-4-2)9-11-5-6-12(10-14)15-11/h5-6,14H,3-4,7-10H2,1-2H3.
What are the key properties of [5-[(dipropylamino)methyl]furan-2-yl]methanol?
[5-[(dipropylamino)methyl]furan-2-yl]methanol has a molecular weight of 211.31 g/mol, XLogP of 2.39, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(dipropylamino)methyl]furan-2-yl]methanol is sourced from PubChem (CID 115879634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).