N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide

C21H28N2O2 — CID 78898923

IUPACN-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide
SMILESCc1ccc(CN(C(=O)CNC(c2ccccc2)C(C)C)C2CC2)o1
InChIInChI=1S/C21H28N2O2/c1-15(2)21(17-7-5-4-6-8-17)22-13-20(24)23(18-10-11-18)14-19-12-9-16(3)25-19/h4-9,12,15,18,21-22H,10-11,13-14H2,1-3H3
InChIKeyKGNMGQFYQOMAGC-UHFFFAOYSA-N
MW340.47 g/mol
LogP4.07
Rot. Bonds8

About N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide

N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide (PubChem CID 78898923) has the molecular formula C21H28N2O2 and a molecular weight of 340.47 g/mol. Its IUPAC name is N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide
PubChem CID78898923
Molecular FormulaC21H28N2O2
Molecular Weight340.47 g/mol
Exact Mass340.22
IUPAC NameN-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide
SMILESCc1ccc(CN(C(=O)CNC(c2ccccc2)C(C)C)C2CC2)o1
InChIInChI=1S/C21H28N2O2/c1-15(2)21(17-7-5-4-6-8-17)22-13-20(24)23(18-10-11-18)14-19-12-9-16(3)25-19/h4-9,12,15,18,21-22H,10-11,13-14H2,1-3H3
InChIKeyKGNMGQFYQOMAGC-UHFFFAOYSA-N
XLogP4.07
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 54872080
(2R)-2-amino-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-phenylacetamide
CID 61162622
2-amino-N-[2-[cyclopropyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]acetamide
CID 54871939
N-cyclopropyl-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 60794855
N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 60793853
3-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 60949956
N-cyclopropyl-3-(cyclopropylamino)-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 54871938
3-amino-N-cyclopropyl-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 55104325
N-cyclopropyl-5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pentanamide
CID 79198698
(2R)-2-amino-N-cyclopropyl-3,3-dimethyl-N-[(5-methylfuran-2-yl)methyl]butanamide
CID 103929276
2-bromo-N-cyclopropyl-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 114328211
cis-(1S,2R)-2-[cyclopropyl-[(5-methylfuran-2-yl)methyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 93378560

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide?
The IUPAC name of N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide (CID 78898923) is N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide.
What is the SMILES notation for N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide?
The canonical SMILES for N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide is Cc1ccc(CN(C(=O)CNC(c2ccccc2)C(C)C)C2CC2)o1.
What is the InChIKey of N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide?
The InChIKey is KGNMGQFYQOMAGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O2/c1-15(2)21(17-7-5-4-6-8-17)22-13-20(24)23(18-10-11-18)14-19-12-9-16(3)25-19/h4-9,12,15,18,21-22H,10-11,13-14H2,1-3H3.
What are the key properties of N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide?
N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide has a molecular weight of 340.47 g/mol, XLogP of 4.07, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide is sourced from PubChem (CID 78898923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).