N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide

C14H15ClN2O2 — CID 108996274

IUPACN-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide
SMILESCc1cc(Cl)ccc1NC(=O)CNCc1ccco1
InChIInChI=1S/C14H15ClN2O2/c1-10-7-11(15)4-5-13(10)17-14(18)9-16-8-12-3-2-6-19-12/h2-7,16H,8-9H2,1H3,(H,17,18)
InChIKeyLVMBDGAWALDQKI-UHFFFAOYSA-N
MW278.74 g/mol
LogP2.97
Rot. Bonds5

About N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide

N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide (PubChem CID 108996274) has the molecular formula C14H15ClN2O2 and a molecular weight of 278.74 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide
PubChem CID108996274
Molecular FormulaC14H15ClN2O2
Molecular Weight278.74 g/mol
Exact Mass278.08
IUPAC NameN-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide
SMILESCc1cc(Cl)ccc1NC(=O)CNCc1ccco1
InChIInChI=1S/C14H15ClN2O2/c1-10-7-11(15)4-5-13(10)17-14(18)9-16-8-12-3-2-6-19-12/h2-7,16H,8-9H2,1H3,(H,17,18)
InChIKeyLVMBDGAWALDQKI-UHFFFAOYSA-N
XLogP2.97
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide
CID 108996571
4-N-(4-chloro-2-methylphenyl)-1-N-(furan-2-ylmethyl)cyclohexane-1,4-dicarboxamide
CID 109147825
N-(4-chloro-2-methylphenyl)-2-[[(1R)-1-(furan-2-yl)ethyl]amino]acetamide
CID 8919166
2-N-(4-chloro-2-methylphenyl)-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109085088
N-(4-chloro-2-methylphenyl)-2-[furan-2-ylmethyl-[(2-hydroxyphenyl)methyl]amino]acetamide
CID 78821266
N-(2-bromophenyl)-2-(furan-2-ylmethylamino)acetamide
CID 2452076
[2-(4-chloro-2-methylanilino)-2-oxoethyl]-(furan-2-ylmethyl)-(thiophen-2-ylmethyl)azanium
CID 8678016
2-(furan-2-ylmethylamino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 9466798
2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide
CID 1133386
N'-(5-chloro-2-methylphenyl)-N-(furan-2-ylmethyl)ethane-1,2-diamine
CID 54809868
N-(4-chloro-2-methylphenyl)-2-(pentylamino)acetamide
CID 109005960
N-(4-chloro-2-methylphenyl)-2-[[4-(furan-2-ylmethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
CID 662687

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide (CID 108996274) is N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide is Cc1cc(Cl)ccc1NC(=O)CNCc1ccco1.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide?
The InChIKey is LVMBDGAWALDQKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O2/c1-10-7-11(15)4-5-13(10)17-14(18)9-16-8-12-3-2-6-19-12/h2-7,16H,8-9H2,1H3,(H,17,18).
What are the key properties of N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide?
N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide has a molecular weight of 278.74 g/mol, XLogP of 2.97, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide is sourced from PubChem (CID 108996274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).