2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide

C14H22N2O2 — CID 64683581

IUPAC2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide
SMILESCN(Cc1ccco1)C(=O)CC1(N)CCCCC1
InChIInChI=1S/C14H22N2O2/c1-16(11-12-6-5-9-18-12)13(17)10-14(15)7-3-2-4-8-14/h5-6,9H,2-4,7-8,10-11,15H2,1H3
InChIKeyBWQZOASHGGHYHW-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.29
Rot. Bonds4

About 2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide

2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide (PubChem CID 64683581) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide
PubChem CID64683581
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide
SMILESCN(Cc1ccco1)C(=O)CC1(N)CCCCC1
InChIInChI=1S/C14H22N2O2/c1-16(11-12-6-5-9-18-12)13(17)10-14(15)7-3-2-4-8-14/h5-6,9H,2-4,7-8,10-11,15H2,1H3
InChIKeyBWQZOASHGGHYHW-UHFFFAOYSA-N
XLogP2.29
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(furan-2-ylmethyl)-N,3-dimethylbutanamide
CID 58845598
1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide
CID 80587658
1-(1-aminocyclobutyl)-3-(furan-2-yl)propan-2-one
CID 116591276
2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide
CID 64683694
methyl 1-aminocyclohexane-1-carboxylate;methyl 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclohexane-1-carboxylate
CID 161049648
1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 61197524
2-(1-aminocyclohexyl)-N-[(3-methoxyphenyl)methyl]-N-methylacetamide
CID 64684867
N-(furan-2-ylmethyl)-N-methyl-2-(methylamino)acetamide
CID 43396056
2-(1-aminocyclopentyl)-N-[(4-methoxyphenyl)methyl]-N-methylacetamide
CID 64684478
2-(1-aminocyclobutyl)-N-[[4-(dimethylamino)phenyl]methyl]-N-methylacetamide
CID 79853909
4-amino-N-(furan-2-ylmethyl)-N-methylpentanamide;hydrochloride
CID 120566075
2-(1-aminocyclobutyl)-N-methyl-N-[(3-methylphenyl)methyl]acetamide
CID 79854781

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide?
The IUPAC name of 2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide (CID 64683581) is 2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide.
What is the SMILES notation for 2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide?
The canonical SMILES for 2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide is CN(Cc1ccco1)C(=O)CC1(N)CCCCC1.
What is the InChIKey of 2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide?
The InChIKey is BWQZOASHGGHYHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-16(11-12-6-5-9-18-12)13(17)10-14(15)7-3-2-4-8-14/h5-6,9H,2-4,7-8,10-11,15H2,1H3.
What are the key properties of 2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide?
2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide has a molecular weight of 250.34 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide is sourced from PubChem (CID 64683581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).