N-(furan-3-ylmethyl)-N,3-dimethylbutanamide

C11H17NO2 — CID 110868913

IUPACN-(furan-3-ylmethyl)-N,3-dimethylbutanamide
SMILESCC(C)CC(=O)N(C)Cc1ccoc1
InChIInChI=1S/C11H17NO2/c1-9(2)6-11(13)12(3)7-10-4-5-14-8-10/h4-5,8-9H,6-7H2,1-3H3
InChIKeySRSGKOIWHHHJGF-UHFFFAOYSA-N
MW195.26 g/mol
LogP2.28
Rot. Bonds4

About N-(furan-3-ylmethyl)-N,3-dimethylbutanamide

N-(furan-3-ylmethyl)-N,3-dimethylbutanamide (PubChem CID 110868913) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-N,3-dimethylbutanamide.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-N,3-dimethylbutanamide
PubChem CID110868913
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC NameN-(furan-3-ylmethyl)-N,3-dimethylbutanamide
SMILESCC(C)CC(=O)N(C)Cc1ccoc1
InChIInChI=1S/C11H17NO2/c1-9(2)6-11(13)12(3)7-10-4-5-14-8-10/h4-5,8-9H,6-7H2,1-3H3
InChIKeySRSGKOIWHHHJGF-UHFFFAOYSA-N
XLogP2.28
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide
CID 78973579
N-(furan-3-ylmethyl)-N-methyl-2-sulfanylpropanamide
CID 107024417
N-(furan-3-ylmethyl)-N,3,3-trimethylbutanamide
CID 110868951
4-[furan-3-ylmethyl(methyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103498062
2-ethoxy-N-(furan-3-ylmethyl)-N-methylacetamide
CID 61216289
5-chloro-N-(furan-3-ylmethyl)-N-methylpentanamide
CID 61422456
1-(furan-3-ylmethyl)-3-hydroxy-1-methylurea
CID 54330793
3-(ethylamino)-N-(furan-3-ylmethyl)-N-methylpropanamide
CID 62834996
2-[1-[2-[furan-3-ylmethyl(methyl)amino]-2-oxoethyl]cyclopentyl]acetic acid
CID 61422945
2-cyano-N-(furan-3-ylmethyl)-N,3-dimethylbutanamide
CID 55208173
N-(furan-2-ylmethyl)-N,3-dimethylbutanamide
CID 58845598
2,2,3,3-tetrafluoro-N-(furan-3-ylmethyl)-N-methylpropanamide
CID 103733157

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-N,3-dimethylbutanamide?
The IUPAC name of N-(furan-3-ylmethyl)-N,3-dimethylbutanamide (CID 110868913) is N-(furan-3-ylmethyl)-N,3-dimethylbutanamide.
What is the SMILES notation for N-(furan-3-ylmethyl)-N,3-dimethylbutanamide?
The canonical SMILES for N-(furan-3-ylmethyl)-N,3-dimethylbutanamide is CC(C)CC(=O)N(C)Cc1ccoc1.
What is the InChIKey of N-(furan-3-ylmethyl)-N,3-dimethylbutanamide?
The InChIKey is SRSGKOIWHHHJGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-9(2)6-11(13)12(3)7-10-4-5-14-8-10/h4-5,8-9H,6-7H2,1-3H3.
What are the key properties of N-(furan-3-ylmethyl)-N,3-dimethylbutanamide?
N-(furan-3-ylmethyl)-N,3-dimethylbutanamide has a molecular weight of 195.26 g/mol, XLogP of 2.28, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-N,3-dimethylbutanamide is sourced from PubChem (CID 110868913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).