[2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol

C15H19NO2 — CID 43743342

IUPAC[2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol
SMILESCC(CCc1ccco1)Nc1ccccc1CO
InChIInChI=1S/C15H19NO2/c1-12(8-9-14-6-4-10-18-14)16-15-7-3-2-5-13(15)11-17/h2-7,10,12,16-17H,8-9,11H2,1H3
InChIKeyXTMRRYSVLZRSDZ-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.21
Rot. Bonds6

About [2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol

[2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol (PubChem CID 43743342) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is [2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol.

Molecular Properties

Compound Name[2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol
PubChem CID43743342
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name[2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol
SMILESCC(CCc1ccco1)Nc1ccccc1CO
InChIInChI=1S/C15H19NO2/c1-12(8-9-14-6-4-10-18-14)16-15-7-3-2-5-13(15)11-17/h2-7,10,12,16-17H,8-9,11H2,1H3
InChIKeyXTMRRYSVLZRSDZ-UHFFFAOYSA-N
XLogP3.21
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol
CID 43715225
3-fluoro-1-N-[4-(furan-2-yl)butan-2-yl]benzene-1,2-diamine
CID 54968206
N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine
CID 60716310
[2-ethoxy-5-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol
CID 60980334
2-amino-3-[4-(furan-2-yl)butan-2-ylamino]benzoic acid
CID 115545393
[2-(heptan-2-ylamino)phenyl]methanol
CID 43743067
4-bromo-2,3-dichloro-N-[4-(furan-2-yl)butan-2-yl]aniline
CID 107787692
N-[4-(furan-2-yl)butan-2-yl]acridin-9-amine
CID 4516381
methyl 2-amino-3-[4-(furan-2-yl)butan-2-ylamino]benzoate
CID 115545394
methyl 4-fluoro-3-[4-(furan-2-yl)butan-2-ylamino]benzoate
CID 43684512
N-[1-(2-chlorophenyl)propan-2-yl]-4-(furan-2-yl)butan-2-amine
CID 43677543
2-[4-(furan-2-yl)butan-2-ylamino]-5-methylbenzoic acid
CID 62516226

Frequently Asked Questions

What is the IUPAC name of [2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol?
The IUPAC name of [2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol (CID 43743342) is [2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol.
What is the SMILES notation for [2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol?
The canonical SMILES for [2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol is CC(CCc1ccco1)Nc1ccccc1CO.
What is the InChIKey of [2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol?
The InChIKey is XTMRRYSVLZRSDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-12(8-9-14-6-4-10-18-14)16-15-7-3-2-5-13(15)11-17/h2-7,10,12,16-17H,8-9,11H2,1H3.
What are the key properties of [2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol?
[2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol has a molecular weight of 245.32 g/mol, XLogP of 3.21, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol is sourced from PubChem (CID 43743342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).