N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide

C10H13ClN2O2 — CID 106688585

IUPACN-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide
SMILESNC(CNC(=O)c1ccoc1Cl)C1CC1
InChIInChI=1S/C10H13ClN2O2/c11-9-7(3-4-15-9)10(14)13-5-8(12)6-1-2-6/h3-4,6,8H,1-2,5,12H2,(H,13,14)
InChIKeyWSHPWFYOZXPKJY-UHFFFAOYSA-N
MW228.68 g/mol
LogP1.40
Rot. Bonds4

About N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide

N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide (PubChem CID 106688585) has the molecular formula C10H13ClN2O2 and a molecular weight of 228.68 g/mol. Its IUPAC name is N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide
PubChem CID106688585
Molecular FormulaC10H13ClN2O2
Molecular Weight228.68 g/mol
Exact Mass228.07
IUPAC NameN-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide
SMILESNC(CNC(=O)c1ccoc1Cl)C1CC1
InChIInChI=1S/C10H13ClN2O2/c11-9-7(3-4-15-9)10(14)13-5-8(12)6-1-2-6/h3-4,6,8H,1-2,5,12H2,(H,13,14)
InChIKeyWSHPWFYOZXPKJY-UHFFFAOYSA-N
XLogP1.40
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.68
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-(2-chloro-2-cyclopropylethyl)furan-3-carboxamide
CID 106690017
N-(2-aminopropyl)-2-chlorofuran-3-carboxamide
CID 106688502
N-(2-amino-2-cyclopropylethyl)-5-bromo-2-chlorobenzamide
CID 113282173
N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide
CID 103872680
N-(2-bromopropyl)-2-chlorofuran-3-carboxamide
CID 106690037
N-(2-amino-2-cyclopropylethyl)-2-chloro-5-nitrobenzamide
CID 115301113
2-chloro-N-(cyclobutylmethyl)furan-3-carboxamide
CID 106685401
N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide
CID 113282152
2-chloro-N-[2-(cyclopropanecarbonylamino)ethyl]furan-3-carboxamide
CID 106687261
N-(2-amino-2-cyclopropylethyl)-2-chloro-6-fluorobenzamide
CID 115301115
N-(2-amino-2-cyclopropylethyl)-2,4-dibromobenzamide
CID 107940139
N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide
CID 103872684

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide?
The IUPAC name of N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide (CID 106688585) is N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide.
What is the SMILES notation for N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide?
The canonical SMILES for N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide is NC(CNC(=O)c1ccoc1Cl)C1CC1.
What is the InChIKey of N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide?
The InChIKey is WSHPWFYOZXPKJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O2/c11-9-7(3-4-15-9)10(14)13-5-8(12)6-1-2-6/h3-4,6,8H,1-2,5,12H2,(H,13,14).
What are the key properties of N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide?
N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide has a molecular weight of 228.68 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide is sourced from PubChem (CID 106688585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).