N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine

C15H26N2O — CID 62461344

IUPACN,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine
SMILESCNCc1occc1CN(C)C1CCCCC1C
InChIInChI=1S/C15H26N2O/c1-12-6-4-5-7-14(12)17(3)11-13-8-9-18-15(13)10-16-2/h8-9,12,14,16H,4-7,10-11H2,1-3H3
InChIKeyNQNJMCCMQMQXRR-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.01
Rot. Bonds5

About N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine

N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine (PubChem CID 62461344) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine
PubChem CID62461344
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine
SMILESCNCc1occc1CN(C)C1CCCCC1C
InChIInChI=1S/C15H26N2O/c1-12-6-4-5-7-14(12)17(3)11-13-8-9-18-15(13)10-16-2/h8-9,12,14,16H,4-7,10-11H2,1-3H3
InChIKeyNQNJMCCMQMQXRR-UHFFFAOYSA-N
XLogP3.01
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-N-[[2-methyl-5-(methylaminomethyl)thiophen-3-yl]methyl]cyclohexan-1-amine
CID 80728304
N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine
CID 62425577
N-methyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]thiolan-3-amine
CID 62422601
N-[[2-methoxy-5-(methylaminomethyl)phenyl]methyl]-N,2-dimethylcyclohexan-1-amine
CID 62018739
N-[[2-(ethylaminomethyl)furan-3-yl]methyl]-N-methylcyclopentanamine
CID 55074631
1-[3-[(2,3-dimethylpiperidin-1-yl)methyl]furan-2-yl]-N-methylmethanamine
CID 62413521
N-[[2-[(tert-butylamino)methyl]furan-3-yl]methyl]-N-methylcyclopentanamine
CID 62417012
N-methyl-1-[3-[(2-methylpiperidin-1-yl)methyl]furan-2-yl]methanamine
CID 62438856
N-[[5-[[methyl-[[2-(methylaminomethyl)furan-3-yl]methyl]amino]methyl]furan-3-yl]methyl]cyclopentanamine
CID 123405857
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]cyclohexan-1-ol
CID 61426304
trans-(1S,2S)-2-[methyl-[(2-methylfuran-3-yl)methyl]amino]cyclohexan-1-ol
CID 102731964
N-methyl-N-[[2-[(2-methylpropylamino)methyl]furan-3-yl]methyl]cyclopentanamine
CID 62419680

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine?
The IUPAC name of N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine (CID 62461344) is N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine.
What is the SMILES notation for N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine?
The canonical SMILES for N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine is CNCc1occc1CN(C)C1CCCCC1C.
What is the InChIKey of N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine?
The InChIKey is NQNJMCCMQMQXRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-12-6-4-5-7-14(12)17(3)11-13-8-9-18-15(13)10-16-2/h8-9,12,14,16H,4-7,10-11H2,1-3H3.
What are the key properties of N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine?
N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine has a molecular weight of 250.39 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine is sourced from PubChem (CID 62461344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).