N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine

C14H23NO3 — CID 62444720

IUPACN-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine
SMILESCNCc1cc(COCC2CCCCO2)c(C)o1
InChIInChI=1S/C14H23NO3/c1-11-12(7-14(18-11)8-15-2)9-16-10-13-5-3-4-6-17-13/h7,13,15H,3-6,8-10H2,1-2H3
InChIKeyMSNOLFYEAYHPDO-UHFFFAOYSA-N
MW253.34 g/mol
LogP2.39
Rot. Bonds6

About N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine

N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine (PubChem CID 62444720) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine
PubChem CID62444720
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC NameN-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine
SMILESCNCc1cc(COCC2CCCCO2)c(C)o1
InChIInChI=1S/C14H23NO3/c1-11-12(7-14(18-11)8-15-2)9-16-10-13-5-3-4-6-17-13/h7,13,15H,3-6,8-10H2,1-2H3
InChIKeyMSNOLFYEAYHPDO-UHFFFAOYSA-N
XLogP2.39
TPSA43.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine
CID 62445276
N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 62446310
N-methyl-1-[5-methyl-4-[(1-methylpiperidin-2-yl)methoxymethyl]furan-2-yl]methanamine
CID 65468080
1-[5-(cyclopentylmethoxymethyl)-2-methylfuran-3-yl]-N-methylmethanamine
CID 66323991
N-methyl-1-[5-methyl-4-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]furan-2-yl]methanamine
CID 62456474
N-[[4-(cyclopentylmethoxymethyl)-5-methylfuran-2-yl]methyl]-2-methylpropan-2-amine
CID 66324001
N-methyl-1-[5-methyl-4-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methanamine
CID 55076653
N-methyl-1-[5-methyl-4-(2-piperidin-1-ylethoxymethyl)furan-2-yl]methanamine
CID 62460576
2-methyl-N-[[5-methyl-4-(oxan-2-ylmethoxymethyl)thiophen-2-yl]methyl]propan-1-amine
CID 80720268
N-methyl-1-[6-methyl-4-(oxan-2-ylmethoxy)-3-pyridinyl]methanamine
CID 81255345
N-methyl-1-[2-[2-(oxan-2-ylmethoxy)ethoxy]phenyl]methanamine
CID 62444128
N-methyl-N-[[2-methyl-5-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine
CID 62425372

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine?
The IUPAC name of N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine (CID 62444720) is N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine is CNCc1cc(COCC2CCCCO2)c(C)o1.
What is the InChIKey of N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine?
The InChIKey is MSNOLFYEAYHPDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-11-12(7-14(18-11)8-15-2)9-16-10-13-5-3-4-6-17-13/h7,13,15H,3-6,8-10H2,1-2H3.
What are the key properties of N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine?
N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine has a molecular weight of 253.34 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine is sourced from PubChem (CID 62444720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).