N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide

C10H16FNO — CID 126991129

IUPACN-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NCC1(F)CCC1
InChIInChI=1S/C10H16FNO/c1-7-5-8(7)9(13)12-6-10(11)3-2-4-10/h7-8H,2-6H2,1H3,(H,12,13)
InChIKeyPLNCWPGMILAGLB-UHFFFAOYSA-N
MW185.24 g/mol
LogP1.65
Rot. Bonds3

About N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide

N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide (PubChem CID 126991129) has the molecular formula C10H16FNO and a molecular weight of 185.24 g/mol. Its IUPAC name is N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide
PubChem CID126991129
Molecular FormulaC10H16FNO
Molecular Weight185.24 g/mol
Exact Mass185.12
IUPAC NameN-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NCC1(F)CCC1
InChIInChI=1S/C10H16FNO/c1-7-5-8(7)9(13)12-6-10(11)3-2-4-10/h7-8H,2-6H2,1H3,(H,12,13)
InChIKeyPLNCWPGMILAGLB-UHFFFAOYSA-N
XLogP1.65
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.24
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-N-[(1-methylcyclobutyl)methyl]cyclopropane-1-carboxamide
CID 130727562
1-[[3-[(2-methylcyclopropanecarbonyl)amino]propanoylamino]methyl]cyclobutane-1-carboxylic acid
CID 81362085
2-methyl-N-[(4-propylpiperidin-4-yl)methyl]cyclopropane-1-carboxamide
CID 114280588
trans-(1S,2S)-2-methyl-N-(1-methylcyclobutyl)cyclopropane-1-carboxamide
CID 130646724
2,2-difluoro-N-[(1-fluorocyclobutyl)methyl]acetamide
CID 130666100
cis-(1R,2S)-2-methyl-N-propylcyclopropane-1-carboxamide
CID 95357811
N-[3-[[1-(hydroxymethyl)cyclopentyl]methylamino]-3-oxopropyl]-2-methylcyclopropane-1-carboxamide
CID 115362728
2-methyl-N-[2-(methylamino)ethyl]cyclopropane-1-carboxamide
CID 62657204
2-[1-[3-[(2-methylcyclopropanecarbonyl)amino]propanoylamino]cyclobutyl]acetic acid
CID 79845909
2-cyano-N-[(1-fluorocyclobutyl)methyl]acetamide
CID 130666101
2-[(1-methylcyclopropyl)methylcarbamoyl]cyclopropane-1-carboxylic acid
CID 103790364
N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide
CID 165476129

Frequently Asked Questions

What is the IUPAC name of N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide (CID 126991129) is N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide is CC1CC1C(=O)NCC1(F)CCC1.
What is the InChIKey of N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide?
The InChIKey is PLNCWPGMILAGLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FNO/c1-7-5-8(7)9(13)12-6-10(11)3-2-4-10/h7-8H,2-6H2,1H3,(H,12,13).
What are the key properties of N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide?
N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide has a molecular weight of 185.24 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-fluorocyclobutyl)methyl]-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 126991129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).