4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol

C14H25NO2 — CID 103787562

IUPAC4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol
SMILESCC(CCc1ccco1)NCC(C)(C)CCO
InChIInChI=1S/C14H25NO2/c1-12(6-7-13-5-4-10-17-13)15-11-14(2,3)8-9-16/h4-5,10,12,15-16H,6-9,11H2,1-3H3
InChIKeyQARRMCPIAAPQJW-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.60
Rot. Bonds8

About 4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol

4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol (PubChem CID 103787562) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol.

Molecular Properties

Compound Name4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol
PubChem CID103787562
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol
SMILESCC(CCc1ccco1)NCC(C)(C)CCO
InChIInChI=1S/C14H25NO2/c1-12(6-7-13-5-4-10-17-13)15-11-14(2,3)8-9-16/h4-5,10,12,15-16H,6-9,11H2,1-3H3
InChIKeyQARRMCPIAAPQJW-UHFFFAOYSA-N
XLogP2.60
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(furan-2-ylmethyl)-2-[(4-hydroxy-2,2-dimethylbutyl)amino]propanamide
CID 106146484
N'-tert-butyl-N-[4-(furan-2-yl)butan-2-yl]ethane-1,2-diamine
CID 107444697
N-but-2-ynyl-4-(furan-2-yl)butan-2-amine
CID 62311547
N-butyl-4-(furan-2-yl)butan-2-amine
CID 43182419
1-tert-butyl-3-[4-(furan-2-yl)butan-2-yl]urea
CID 115571913
N-(2-tert-butylsulfonylethyl)-4-(furan-2-yl)butan-2-amine
CID 103902199
N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine
CID 43205393
3-ethyl-N-[4-(furan-2-yl)butan-2-yl]pentan-2-amine
CID 63842275
2-[1-[4-(furan-2-yl)butan-2-ylamino]ethyl]phenol
CID 43205349
3-[[4-(furan-2-yl)butan-2-ylamino]methyl]cyclobutan-1-ol
CID 66004063
methyl 2-[4-(furan-2-yl)butan-2-ylamino]-2-methylpropanoate
CID 43726163
4-(furan-2-yl)-N-[(E)-3-phenylprop-2-enyl]butan-2-amine
CID 62339939

Frequently Asked Questions

What is the IUPAC name of 4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol?
The IUPAC name of 4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol (CID 103787562) is 4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol.
What is the SMILES notation for 4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol?
The canonical SMILES for 4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol is CC(CCc1ccco1)NCC(C)(C)CCO.
What is the InChIKey of 4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol?
The InChIKey is QARRMCPIAAPQJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-12(6-7-13-5-4-10-17-13)15-11-14(2,3)8-9-16/h4-5,10,12,15-16H,6-9,11H2,1-3H3.
What are the key properties of 4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol?
4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol has a molecular weight of 239.36 g/mol, XLogP of 2.60, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(furan-2-yl)butan-2-ylamino]-3,3-dimethylbutan-1-ol is sourced from PubChem (CID 103787562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).