N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

C14H27NO2 — CID 56743494

IUPACN-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCOCC(C)(C)CNC(=O)C1C(C)(C)C1(C)C
InChIInChI=1S/C14H27NO2/c1-12(2,9-17-7)8-15-11(16)10-13(3,4)14(10,5)6/h10H,8-9H2,1-7H3,(H,15,16)
InChIKeyXMFARTRZKKFXRH-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.46
Rot. Bonds5

About N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (PubChem CID 56743494) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
PubChem CID56743494
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCOCC(C)(C)CNC(=O)C1C(C)(C)C1(C)C
InChIInChI=1S/C14H27NO2/c1-12(2,9-17-7)8-15-11(16)10-13(3,4)14(10,5)6/h10H,8-9H2,1-7H3,(H,15,16)
InChIKeyXMFARTRZKKFXRH-UHFFFAOYSA-N
XLogP2.46
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclopropanecarboxamide, N,2,2,3,3-pentamethyl-
CID 177237
N-(2-amino-2-oxoethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 10058570
N-(2-hydroxyethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 11183050
N-ethyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 11480684
N-(2-fluoroethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 11424015
N-(2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 11424187
N-Ethyl-2-isopropyl-2,4-dimethylvaleramide
CID 101044
3,3,4-Trimethyl-N-(3-methylbutyl)pentanamide
CID 71386918
3,3,4-Trimethyl-N-(2-methylbutyl)pentanamide
CID 71386919
N-(2,2-difluoro-3-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 104858100
2-(2,2,3,3,4-Pentamethylpentanoylamino)ethyl hypofluorite
CID 172314074
N-(3-butoxypropyl)-2-methylpentanamide
CID 2914717

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The IUPAC name of N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (CID 56743494) is N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The canonical SMILES for N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is COCC(C)(C)CNC(=O)C1C(C)(C)C1(C)C.
What is the InChIKey of N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The InChIKey is XMFARTRZKKFXRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-12(2,9-17-7)8-15-11(16)10-13(3,4)14(10,5)6/h10H,8-9H2,1-7H3,(H,15,16).
What are the key properties of N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide has a molecular weight of 241.37 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxy-2,2-dimethylpropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is sourced from PubChem (CID 56743494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).