1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide

C23H29NO3 — CID 51130985

IUPAC1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide
SMILESCOc1ccccc1C1(C(=O)NCCc2ccc(OC(C)C)cc2)CCC1
InChIInChI=1S/C23H29NO3/c1-17(2)27-19-11-9-18(10-12-19)13-16-24-22(25)23(14-6-15-23)20-7-4-5-8-21(20)26-3/h4-5,7-12,17H,6,13-16H2,1-3H3,(H,24,25)
InChIKeySROWIBSORNVECH-UHFFFAOYSA-N
MW367.49 g/mol
LogP4.26
Rot. Bonds8

About 1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide

1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide (PubChem CID 51130985) has the molecular formula C23H29NO3 and a molecular weight of 367.49 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide
PubChem CID51130985
Molecular FormulaC23H29NO3
Molecular Weight367.49 g/mol
Exact Mass367.21
IUPAC Name1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide
SMILESCOc1ccccc1C1(C(=O)NCCc2ccc(OC(C)C)cc2)CCC1
InChIInChI=1S/C23H29NO3/c1-17(2)27-19-11-9-18(10-12-19)13-16-24-22(25)23(14-6-15-23)20-7-4-5-8-21(20)26-3/h4-5,7-12,17H,6,13-16H2,1-3H3,(H,24,25)
InChIKeySROWIBSORNVECH-UHFFFAOYSA-N
XLogP4.26
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.49
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-fluorophenyl)ethyl]-1-(2-methoxyphenyl)cyclobutane-1-carboxamide
CID 110438088
N-[3-(dimethylamino)propyl]-1-(2-methoxyphenyl)cyclobutane-1-carboxamide
CID 110438073
1-(4-chloro-2-methoxyphenyl)-N-[2-(4-phenylmethoxyphenyl)ethyl]cyclobutane-1-carboxamide
CID 66868466
N-[3-(dimethylamino)propyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide
CID 110437951
4-[[1-(2-methoxyphenyl)cyclopropanecarbonyl]amino]butanoic acid
CID 110466088
N-[2-(4-methoxyphenyl)ethyl]-1-phenylcyclopentane-1-carboxamide
CID 4682158
1-(2-methoxyphenyl)-N-prop-2-enylcyclobutane-1-carboxamide
CID 110486813
2-[[1-(2-methoxyphenyl)cyclopentanecarbonyl]amino]acetic acid
CID 110466240
1-[(1-hydroxycyclopentyl)methyl]-3-[2-(4-propan-2-yloxyphenyl)ethyl]urea
CID 111104008
N-[[4-(2-methoxyphenyl)oxan-4-yl]methyl]-4-propan-2-yloxybenzamide
CID 27449266
3-[[1-(2-methoxyphenyl)cyclopropanecarbonyl]amino]butanoic acid
CID 119220664
3-[2-[[1-(2-methoxyphenyl)cyclohexanecarbonyl]amino]ethyldisulfanyl]propanoic acid
CID 166422320

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide?
The IUPAC name of 1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide (CID 51130985) is 1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide?
The canonical SMILES for 1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide is COc1ccccc1C1(C(=O)NCCc2ccc(OC(C)C)cc2)CCC1.
What is the InChIKey of 1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide?
The InChIKey is SROWIBSORNVECH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29NO3/c1-17(2)27-19-11-9-18(10-12-19)13-16-24-22(25)23(14-6-15-23)20-7-4-5-8-21(20)26-3/h4-5,7-12,17H,6,13-16H2,1-3H3,(H,24,25).
What are the key properties of 1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide?
1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide has a molecular weight of 367.49 g/mol, XLogP of 4.26, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]cyclobutane-1-carboxamide is sourced from PubChem (CID 51130985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).