2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide

C16H21N3O2 — CID 167784536

IUPAC2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide
SMILESCc1ccc(CN(Cc2ccccn2)C(=O)CN(C)C)o1
InChIInChI=1S/C16H21N3O2/c1-13-7-8-15(21-13)11-19(16(20)12-18(2)3)10-14-6-4-5-9-17-14/h4-9H,10-12H2,1-3H3
InChIKeyUYCFIOXYTZLSIY-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.07
Rot. Bonds6

About 2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide

2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 167784536) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide
PubChem CID167784536
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide
SMILESCc1ccc(CN(Cc2ccccn2)C(=O)CN(C)C)o1
InChIInChI=1S/C16H21N3O2/c1-13-7-8-15(21-13)11-19(16(20)12-18(2)3)10-14-6-4-5-9-17-14/h4-9H,10-12H2,1-3H3
InChIKeyUYCFIOXYTZLSIY-UHFFFAOYSA-N
XLogP2.07
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N'-[(5-methylfuran-2-yl)methyl]-N'-(2-pyridin-2-ylethyl)oxamide
CID 174561707
N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]acetamide
CID 134055397
N-[2-(dimethylamino)ethyl]-5-ethyl-N-(pyridin-2-ylmethyl)furan-2-carboxamide
CID 56783054
N-[[5-(aminomethyl)furan-2-yl]methyl]-N-methyl-2-pyridin-2-ylethanamine
CID 62419402
[5-[[methyl(2-pyridin-2-ylethyl)amino]methyl]furan-2-yl]methanol
CID 113372422
N-(furan-2-ylmethyl)-2-phenoxy-N-(pyridin-2-ylmethyl)acetamide
CID 121084642
N-(furan-2-ylmethyl)-4-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 121084627
N-[2-[benzyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]-N-propylpropanamide
CID 4252253
N-(furan-2-ylmethyl)-2-methyl-N-(pyridin-2-ylmethyl)propanamide
CID 4085276
N-benzyl-2-[dimethylcarbamoyl(prop-2-enyl)amino]-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 3548187
N-ethyl-N-(pyridin-2-ylmethyl)-3-sulfanylpropanamide
CID 107032625
2-amino-N-[2-(dimethylamino)ethyl]-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 54873875

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide (CID 167784536) is 2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide is Cc1ccc(CN(Cc2ccccn2)C(=O)CN(C)C)o1.
What is the InChIKey of 2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is UYCFIOXYTZLSIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-13-7-8-15(21-13)11-19(16(20)12-18(2)3)10-14-6-4-5-9-17-14/h4-9H,10-12H2,1-3H3.
What are the key properties of 2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide?
2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 287.36 g/mol, XLogP of 2.07, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[(5-methylfuran-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 167784536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).