N-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide

C10H16FNO — CID 130638395

IUPACN-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide
SMILESCC(CF)NC(=O)C1CC12CCC2
InChIInChI=1S/C10H16FNO/c1-7(6-11)12-9(13)8-5-10(8)3-2-4-10/h7-8H,2-6H2,1H3,(H,12,13)
InChIKeyAPZWECABZILCNK-UHFFFAOYSA-N
MW185.24 g/mol
LogP1.65
Rot. Bonds3

About N-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide

N-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide (PubChem CID 130638395) has the molecular formula C10H16FNO and a molecular weight of 185.24 g/mol. Its IUPAC name is N-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide.

Molecular Properties

Compound NameN-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide
PubChem CID130638395
Molecular FormulaC10H16FNO
Molecular Weight185.24 g/mol
Exact Mass185.12
IUPAC NameN-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide
SMILESCC(CF)NC(=O)C1CC12CCC2
InChIInChI=1S/C10H16FNO/c1-7(6-11)12-9(13)8-5-10(8)3-2-4-10/h7-8H,2-6H2,1H3,(H,12,13)
InChIKeyAPZWECABZILCNK-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

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N-Isopropyl-2,3-dimethyl-2-(1-methylpropyl)valeramide
CID 3016608
N-(3-fluoro-3,4-dimethylhexan-2-yl)hexanamide
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CID 129154766
2-Tert-butyl-2,4,4,5,5,8,8-heptamethyl-6-(propan-2-ylcarbamoyl)nonanoyl fluoride
CID 132048567
4-[2-[3,3-dimethylbutanoyl(methyl)amino]cyclopropyl]-N-(2-fluoroethyl)-3,3-dimethylbutanamide
CID 134482633
(2R)-N-ethyl-2-(3-fluoro-3-methylcyclobutyl)propanamide
CID 156093161
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CID 156093514

Frequently Asked Questions

What is the IUPAC name of N-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide?
The IUPAC name of N-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide (CID 130638395) is N-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide.
What is the SMILES notation for N-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide?
The canonical SMILES for N-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide is CC(CF)NC(=O)C1CC12CCC2.
What is the InChIKey of N-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide?
The InChIKey is APZWECABZILCNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FNO/c1-7(6-11)12-9(13)8-5-10(8)3-2-4-10/h7-8H,2-6H2,1H3,(H,12,13).
What are the key properties of N-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide?
N-(1-fluoropropan-2-yl)spiro[2.3]hexane-2-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-fluoropropan-2-yl)spiro[2.3]hexane-2-carboxamide is sourced from PubChem (CID 130638395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).