4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide

C14H20N2O3 — CID 66248648

IUPAC4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide
SMILESCOCc1ccccc1NC(=O)C1(C)COCC1N
InChIInChI=1S/C14H20N2O3/c1-14(9-19-8-12(14)15)13(17)16-11-6-4-3-5-10(11)7-18-2/h3-6,12H,7-9,15H2,1-2H3,(H,16,17)
InChIKeyBECUKWILZIBENY-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.14
Rot. Bonds4

About 4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide

4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide (PubChem CID 66248648) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide
PubChem CID66248648
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide
SMILESCOCc1ccccc1NC(=O)C1(C)COCC1N
InChIInChI=1S/C14H20N2O3/c1-14(9-19-8-12(14)15)13(17)16-11-6-4-3-5-10(11)7-18-2/h3-6,12H,7-9,15H2,1-2H3,(H,16,17)
InChIKeyBECUKWILZIBENY-UHFFFAOYSA-N
XLogP1.14
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(2-ethylphenyl)-3-methyloxolane-3-carboxamide
CID 66250197
4-amino-N-[2-(dimethylcarbamoyl)phenyl]-3-methyloxolane-3-carboxamide
CID 66249041
4-amino-N-[3-(2-methoxyethoxy)phenyl]-3-methyloxolane-3-carboxamide
CID 66250431
4-amino-N-[3-chloro-2-(dimethylamino)phenyl]-3-methyloxolane-3-carboxamide
CID 66249432
4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide
CID 66263037
4-amino-N-(2,4-dimethylphenyl)-3-methyloxolane-3-carboxamide
CID 66248237
4-amino-N-(4-ethoxyphenyl)-3-methyloxolane-3-carboxamide
CID 66248425
4-amino-N-[4-(ethylcarbamoyl)phenyl]-3-methyloxolane-3-carboxamide
CID 66250037
4-amino-3-methyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide
CID 66248831
1-carbamothioyl-N-[2-(methoxymethyl)phenyl]cyclobutane-1-carboxamide
CID 80589984
4-amino-N-[4-(diethylamino)phenyl]-3-methyloxolane-3-carboxamide
CID 66249241
4-amino-3-methyl-N-(3-phenylmethoxypropyl)oxolane-3-carboxamide
CID 66251047

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide?
The IUPAC name of 4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide (CID 66248648) is 4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide is COCc1ccccc1NC(=O)C1(C)COCC1N.
What is the InChIKey of 4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide?
The InChIKey is BECUKWILZIBENY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-14(9-19-8-12(14)15)13(17)16-11-6-4-3-5-10(11)7-18-2/h3-6,12H,7-9,15H2,1-2H3,(H,16,17).
What are the key properties of 4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide?
4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide has a molecular weight of 264.32 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(methoxymethyl)phenyl]-3-methyloxolane-3-carboxamide is sourced from PubChem (CID 66248648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).