2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide

C15H25NO2 — CID 86978108

IUPAC2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide
SMILESCc1cc(C(=O)N(CC(C)C)CC(C)C)c(C)o1
InChIInChI=1S/C15H25NO2/c1-10(2)8-16(9-11(3)4)15(17)14-7-12(5)18-13(14)6/h7,10-11H,8-9H2,1-6H3
InChIKeyUUGOVZRQEWDGKF-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.65
Rot. Bonds5

About 2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide

2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide (PubChem CID 86978108) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide
PubChem CID86978108
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide
SMILESCc1cc(C(=O)N(CC(C)C)CC(C)C)c(C)o1
InChIInChI=1S/C15H25NO2/c1-10(2)8-16(9-11(3)4)15(17)14-7-12(5)18-13(14)6/h7,10-11H,8-9H2,1-6H3
InChIKeyUUGOVZRQEWDGKF-UHFFFAOYSA-N
XLogP3.65
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(diethylamino)-3-oxopropyl]-2,5-dimethyl-N-(2-methylpropyl)furan-3-carboxamide
CID 3591637
2,5-dimethyl-N-(3-methylbutyl)furan-3-carboxamide
CID 35523982
N-(2-chloroethyl)-N-(2,2-difluoroethyl)-2,5-dimethylfuran-3-carboxamide
CID 107491208
N-[3-[(4-fluorophenyl)methylamino]-3-oxopropyl]-2,5-dimethyl-N-(2-methylpropyl)furan-3-carboxamide
CID 4181128
N-[3-(diethylamino)-3-oxopropyl]-N-ethyl-2,5-dimethylfuran-3-carboxamide
CID 3303521
N-(2-bromoethyl)-2,5-dimethyl-N-propan-2-ylfuran-3-carboxamide
CID 80666211
3-methylbutyl 2,5-dimethylfuran-3-carboxylate
CID 78832539
2-[(2,5-dimethylfuran-3-carbonyl)-(2,2,2-trifluoroethyl)amino]acetic acid
CID 78990637
methyl 2-[(2,5-dimethylfuran-3-carbonyl)-propan-2-ylamino]acetate
CID 54942114
(2,5-dimethylfuran-3-carbonyl)-methylcarbamic acid;hydrochloride
CID 70634748
2,5-dimethyl-N-[2-methyl-3-(methylamino)propyl]furan-3-carboxamide
CID 81487603
5-amino-2,4-dimethyl-N,N-bis(2-methylpropyl)benzamide
CID 102705085

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide?
The IUPAC name of 2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide (CID 86978108) is 2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide.
What is the SMILES notation for 2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide?
The canonical SMILES for 2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide is Cc1cc(C(=O)N(CC(C)C)CC(C)C)c(C)o1.
What is the InChIKey of 2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide?
The InChIKey is UUGOVZRQEWDGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-10(2)8-16(9-11(3)4)15(17)14-7-12(5)18-13(14)6/h7,10-11H,8-9H2,1-6H3.
What are the key properties of 2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide?
2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide has a molecular weight of 251.37 g/mol, XLogP of 3.65, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N,N-bis(2-methylpropyl)furan-3-carboxamide is sourced from PubChem (CID 86978108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).