2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide

C15H24N2O2 — CID 104678131

IUPAC2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide
SMILESCc1ccc(CNC(=O)CC2(CN)CCCCC2)o1
InChIInChI=1S/C15H24N2O2/c1-12-5-6-13(19-12)10-17-14(18)9-15(11-16)7-3-2-4-8-15/h5-6H,2-4,7-11,16H2,1H3,(H,17,18)
InChIKeyGJZNBTWIYFYZGF-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.50
Rot. Bonds5

About 2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide

2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide (PubChem CID 104678131) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide
PubChem CID104678131
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide
SMILESCc1ccc(CNC(=O)CC2(CN)CCCCC2)o1
InChIInChI=1S/C15H24N2O2/c1-12-5-6-13(19-12)10-17-14(18)9-15(11-16)7-3-2-4-8-15/h5-6H,2-4,7-11,16H2,1H3,(H,17,18)
InChIKeyGJZNBTWIYFYZGF-UHFFFAOYSA-N
XLogP2.50
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(aminomethyl)cyclopentyl]methyl]-1-(5-methylfuran-2-yl)methanamine
CID 115435543
2-[1-(aminomethyl)cyclobutyl]-N-[1-(5-methylfuran-2-yl)ethyl]acetamide
CID 81178711
N-(furan-2-ylmethyl)-2-[1-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclopentyl]acetamide
CID 134025362
2-(1-adamantyl)-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 131949848
2-[1-(aminomethyl)cyclohexyl]-N-(1,2-oxazol-3-ylmethyl)acetamide
CID 113440200
2-[1-(aminomethyl)cyclohexyl]-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 104677578
N-(2-aminoethyl)-2-[1-(aminomethyl)cyclohexyl]acetamide
CID 104677966
5-amino-4-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide
CID 82012174
2-[1-(aminomethyl)cyclohexyl]-N-[(4-cyanophenyl)methyl]acetamide
CID 104677749
2-[1-(aminomethyl)cyclohexyl]-N-methylacetamide
CID 59780086
3-methyl-N-[(5-methylfuran-2-yl)methyl]butanamide
CID 110731621
2-[1-(aminomethyl)cyclobutyl]-N-[(2-methyloxolan-2-yl)methyl]acetamide
CID 81169258

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide?
The IUPAC name of 2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide (CID 104678131) is 2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide.
What is the SMILES notation for 2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide?
The canonical SMILES for 2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide is Cc1ccc(CNC(=O)CC2(CN)CCCCC2)o1.
What is the InChIKey of 2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide?
The InChIKey is GJZNBTWIYFYZGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-12-5-6-13(19-12)10-17-14(18)9-15(11-16)7-3-2-4-8-15/h5-6H,2-4,7-11,16H2,1H3,(H,17,18).
What are the key properties of 2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide?
2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide has a molecular weight of 264.37 g/mol, XLogP of 2.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide is sourced from PubChem (CID 104678131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).