3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide

C14H21N3O2 — CID 64891107

IUPAC3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide
SMILESCN(C)Cc1ccccc1NC(=O)C1(N)CCOC1
InChIInChI=1S/C14H21N3O2/c1-17(2)9-11-5-3-4-6-12(11)16-13(18)14(15)7-8-19-10-14/h3-6H,7-10,15H2,1-2H3,(H,16,18)
InChIKeyXNBKBZSZMALDIA-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.80
Rot. Bonds4

About 3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide

3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide (PubChem CID 64891107) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide
PubChem CID64891107
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide
SMILESCN(C)Cc1ccccc1NC(=O)C1(N)CCOC1
InChIInChI=1S/C14H21N3O2/c1-17(2)9-11-5-3-4-6-12(11)16-13(18)14(15)7-8-19-10-14/h3-6H,7-10,15H2,1-2H3,(H,16,18)
InChIKeyXNBKBZSZMALDIA-UHFFFAOYSA-N
XLogP0.80
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-amino-N-[2-(ethoxymethyl)phenyl]oxolane-3-carboxamide
CID 64891108
N-[2-[[acetyl(methyl)amino]methyl]phenyl]-1-aminocyclopropane-1-carboxamide
CID 65464216
3-amino-N-[2-(pyrazol-1-ylmethyl)phenyl]oxolane-3-carboxamide
CID 64892317
3-amino-N-(2-sulfamoylphenyl)oxolane-3-carboxamide
CID 64893383
3-amino-N-(3-bromo-2-hydroxyphenyl)oxolane-3-carboxamide
CID 81499886
1-amino-N-(2-ethylphenyl)cyclopropane-1-carboxamide
CID 65465258
N-[2-[(dimethylamino)methyl]phenyl]acetamide;ethane
CID 142252989
3-amino-N-(2-piperidin-1-ylphenyl)oxolane-3-carboxamide
CID 64894020
3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide
CID 64891921
3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide
CID 64893957
3-amino-N-(2-prop-2-enylsulfanylphenyl)oxolane-3-carboxamide
CID 64892131
2-amino-N-[2-[(dimethylamino)methyl]phenyl]acetamide
CID 43695681

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide (CID 64891107) is 3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide is CN(C)Cc1ccccc1NC(=O)C1(N)CCOC1.
What is the InChIKey of 3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide?
The InChIKey is XNBKBZSZMALDIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-17(2)9-11-5-3-4-6-12(11)16-13(18)14(15)7-8-19-10-14/h3-6H,7-10,15H2,1-2H3,(H,16,18).
What are the key properties of 3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide?
3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide is sourced from PubChem (CID 64891107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).