2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol

C9H15NO2 — CID 82412815

IUPAC2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol
SMILESCc1ccc(C(O)C(C)(C)N)o1
InChIInChI=1S/C9H15NO2/c1-6-4-5-7(12-6)8(11)9(2,3)10/h4-5,8,11H,10H2,1-3H3
InChIKeyOSQFTNFWUFPPKC-UHFFFAOYSA-N
MW169.22 g/mol
LogP1.36
Rot. Bonds2

About 2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol

2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol (PubChem CID 82412815) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is 2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol.

Molecular Properties

Compound Name2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol
PubChem CID82412815
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol
SMILESCc1ccc(C(O)C(C)(C)N)o1
InChIInChI=1S/C9H15NO2/c1-6-4-5-7(12-6)8(11)9(2,3)10/h4-5,8,11H,10H2,1-3H3
InChIKeyOSQFTNFWUFPPKC-UHFFFAOYSA-N
XLogP1.36
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-2,2-dimethyl-1-(5-methylfuran-2-yl)but-3-en-1-ol
CID 45139861
(1S,2R)-1-amino-1-(5-methylfuran-2-yl)propan-2-ol
CID 131206305
1-[5-(1-hydroxy-2,2-dimethylpropyl)furan-2-yl]-2,2-dimethylpropan-1-ol
CID 155481572
2-(3,3-dimethylbutan-2-yl)-5-methylfuran
CID 77433390
(1R)-4-methyl-1-(5-methylfuran-2-yl)pent-2-yne-1,4-diol
CID 699020
1-(5-methylfuran-2-yl)propan-1-ol
CID 14570731
4-amino-1-(5-methylfuran-2-yl)butan-1-ol
CID 82412823
2-(2,2-dimethylpropylamino)-1-(5-methylfuran-2-yl)ethanol
CID 115646640
2-methyl-5-[(2S)-3-methylbutan-2-yl]furan
CID 59302907
(1S)-2-amino-2-methyl-1-phenylpropan-1-ol
CID 38988546
propan-2-yl (2R)-2-hydroxy-2-(5-methylfuran-2-yl)acetate
CID 102354808
(3R)-3-amino-2,2-difluoro-3-(5-methylfuran-2-yl)propan-1-ol
CID 130649581

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol?
The IUPAC name of 2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol (CID 82412815) is 2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol.
What is the SMILES notation for 2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol?
The canonical SMILES for 2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol is Cc1ccc(C(O)C(C)(C)N)o1.
What is the InChIKey of 2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol?
The InChIKey is OSQFTNFWUFPPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-6-4-5-7(12-6)8(11)9(2,3)10/h4-5,8,11H,10H2,1-3H3.
What are the key properties of 2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol?
2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol has a molecular weight of 169.22 g/mol, XLogP of 1.36, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-1-(5-methylfuran-2-yl)propan-1-ol is sourced from PubChem (CID 82412815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).