N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide

C12H17NO3 — CID 60793853

IUPACN-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide
SMILESCOCC(=O)N(Cc1ccc(C)o1)C1CC1
InChIInChI=1S/C12H17NO3/c1-9-3-6-11(16-9)7-13(10-4-5-10)12(14)8-15-2/h3,6,10H,4-5,7-8H2,1-2H3
InChIKeyQFSRMPPNUBLPKD-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.73
Rot. Bonds5

About N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide

N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide (PubChem CID 60793853) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide
PubChem CID60793853
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC NameN-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide
SMILESCOCC(=O)N(Cc1ccc(C)o1)C1CC1
InChIInChI=1S/C12H17NO3/c1-9-3-6-11(16-9)7-13(10-4-5-10)12(14)8-15-2/h3,6,10H,4-5,7-8H2,1-2H3
InChIKeyQFSRMPPNUBLPKD-UHFFFAOYSA-N
XLogP1.73
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-(3-methylazetidin-3-yl)oxy-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 102655903
3-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 60949956
2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 87005207
N-cyclopropyl-5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pentanamide
CID 79198698
N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 54872080
N-cyclopropyl-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 60794855
2-bromo-N-cyclopropyl-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 114328211
N-cyclopropyl-3-(cyclopropylamino)-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 54871938
2-amino-N-[2-[cyclopropyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]acetamide
CID 54871939
2-(benzotriazol-1-yloxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 71997092
3-chloro-N-cyclopropyl-2,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 63665475
N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-piperidin-4-ylsulfanylacetamide
CID 114627014

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide?
The IUPAC name of N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide (CID 60793853) is N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide?
The canonical SMILES for N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide is COCC(=O)N(Cc1ccc(C)o1)C1CC1.
What is the InChIKey of N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide?
The InChIKey is QFSRMPPNUBLPKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-9-3-6-11(16-9)7-13(10-4-5-10)12(14)8-15-2/h3,6,10H,4-5,7-8H2,1-2H3.
What are the key properties of N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide?
N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide has a molecular weight of 223.27 g/mol, XLogP of 1.73, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide is sourced from PubChem (CID 60793853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).