4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide

C17H20N2O2 — CID 66263037

IUPAC4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide
SMILESCC1(C(=O)NCc2cccc3ccccc23)COCC1N
InChIInChI=1S/C17H20N2O2/c1-17(11-21-10-15(17)18)16(20)19-9-13-7-4-6-12-5-2-3-8-14(12)13/h2-8,15H,9-11,18H2,1H3,(H,19,20)
InChIKeyGHTCYDXMHHSHJM-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.82
Rot. Bonds3

About 4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide

4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide (PubChem CID 66263037) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide
PubChem CID66263037
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide
SMILESCC1(C(=O)NCc2cccc3ccccc23)COCC1N
InChIInChI=1S/C17H20N2O2/c1-17(11-21-10-15(17)18)16(20)19-9-13-7-4-6-12-5-2-3-8-14(12)13/h2-8,15H,9-11,18H2,1H3,(H,19,20)
InChIKeyGHTCYDXMHHSHJM-UHFFFAOYSA-N
XLogP1.82
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-[(3-methoxyphenyl)methyl]-3-methyloxolane-3-carboxamide
CID 66250429
4-amino-N-[(3-ethoxyphenyl)methyl]-3-methyloxolane-3-carboxamide
CID 66250428
4-amino-3-methyl-N-(3-phenylmethoxypropyl)oxolane-3-carboxamide
CID 66251047
4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide
CID 66250212
trans-(3R,5R)-1,3,4,5-tetrahydroxy-N-(naphthalen-1-ylmethyl)cyclohexane-1-carboxamide
CID 151101293
4-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide
CID 66264467
1-naphthalen-1-yl-3-(naphthalen-1-ylmethyl)urea
CID 27185701
2-amino-N-(naphthalen-1-ylmethyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120786171
2-amino-N-(naphthalen-1-ylmethyl)acetamide
CID 62369786
2-amino-N-(naphthalen-1-ylmethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119709547
(1S,5S)-N-(naphthalen-1-ylmethyl)-3-oxa-8-azabicyclo[3.2.1]octane-8-carboxamide
CID 98214795
4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide
CID 66264175

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide?
The IUPAC name of 4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide (CID 66263037) is 4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide?
The canonical SMILES for 4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide is CC1(C(=O)NCc2cccc3ccccc23)COCC1N.
What is the InChIKey of 4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide?
The InChIKey is GHTCYDXMHHSHJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-17(11-21-10-15(17)18)16(20)19-9-13-7-4-6-12-5-2-3-8-14(12)13/h2-8,15H,9-11,18H2,1H3,(H,19,20).
What are the key properties of 4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide?
4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methyl-N-(naphthalen-1-ylmethyl)oxolane-3-carboxamide is sourced from PubChem (CID 66263037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).