1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide

C16H24N2O2 — CID 81169240

IUPAC1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide
SMILESCOc1ccccc1CC(C)N(C)C(=O)C1(N)CCC1
InChIInChI=1S/C16H24N2O2/c1-12(11-13-7-4-5-8-14(13)20-3)18(2)15(19)16(17)9-6-10-16/h4-5,7-8,12H,6,9-11,17H2,1-3H3
InChIKeyKMVJPBKEOMYGCJ-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.97
Rot. Bonds5

About 1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide

1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide (PubChem CID 81169240) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide
PubChem CID81169240
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide
SMILESCOc1ccccc1CC(C)N(C)C(=O)C1(N)CCC1
InChIInChI=1S/C16H24N2O2/c1-12(11-13-7-4-5-8-14(13)20-3)18(2)15(19)16(17)9-6-10-16/h4-5,7-8,12H,6,9-11,17H2,1-3H3
InChIKeyKMVJPBKEOMYGCJ-UHFFFAOYSA-N
XLogP1.97
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 115665268
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(2R)-2-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N,3,3-trimethylbutanamide
CID 103930088
3-ethyl-1-[1-(2-methoxyphenyl)propan-2-yl]-1-methylurea
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methyl 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]-2-oxoacetate
CID 112617368
3-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methyl-3-sulfanylidenepropanamide
CID 65486697
2-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N,4-dimethylpentanamide
CID 65488585
2-(azetidin-3-yl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylacetamide
CID 65488021
1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea
CID 115660984
2-methoxy-N-[1-(2-methoxyphenyl)propan-2-yl]-N,2-dimethylpropanamide
CID 103029189
2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide
CID 65486572
3-(ethylamino)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpropanamide
CID 65488019

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide?
The IUPAC name of 1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide (CID 81169240) is 1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide?
The canonical SMILES for 1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide is COc1ccccc1CC(C)N(C)C(=O)C1(N)CCC1.
What is the InChIKey of 1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide?
The InChIKey is KMVJPBKEOMYGCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12(11-13-7-4-5-8-14(13)20-3)18(2)15(19)16(17)9-6-10-16/h4-5,7-8,12H,6,9-11,17H2,1-3H3.
What are the key properties of 1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide?
1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.97, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclobutane-1-carboxamide is sourced from PubChem (CID 81169240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).