N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine

C14H24N2O2 — CID 82754072

IUPACN,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine
SMILESCNCc1oc(CN(C)C2CCOC2C)cc1C
InChIInChI=1S/C14H24N2O2/c1-10-7-12(18-14(10)8-15-3)9-16(4)13-5-6-17-11(13)2/h7,11,13,15H,5-6,8-9H2,1-4H3
InChIKeyANFPFEAWBJZRFT-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.92
Rot. Bonds5

About N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine

N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine (PubChem CID 82754072) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine
PubChem CID82754072
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC NameN,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine
SMILESCNCc1oc(CN(C)C2CCOC2C)cc1C
InChIInChI=1S/C14H24N2O2/c1-10-7-12(18-14(10)8-15-3)9-16(4)13-5-6-17-11(13)2/h7,11,13,15H,5-6,8-9H2,1-4H3
InChIKeyANFPFEAWBJZRFT-UHFFFAOYSA-N
XLogP1.92
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine?
The IUPAC name of N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine (CID 82754072) is N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine.
What is the SMILES notation for N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine?
The canonical SMILES for N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine is CNCc1oc(CN(C)C2CCOC2C)cc1C.
What is the InChIKey of N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine?
The InChIKey is ANFPFEAWBJZRFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-10-7-12(18-14(10)8-15-3)9-16(4)13-5-6-17-11(13)2/h7,11,13,15H,5-6,8-9H2,1-4H3.
What are the key properties of N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine?
N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine has a molecular weight of 252.36 g/mol, XLogP of 1.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]oxolan-3-amine is sourced from PubChem (CID 82754072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).