N-(furan-2-ylmethyl)-3-methyloxan-4-amine

C11H17NO2 — CID 130173705

IUPACN-(furan-2-ylmethyl)-3-methyloxan-4-amine
SMILESCC1COCCC1NCc1ccco1
InChIInChI=1S/C11H17NO2/c1-9-8-13-6-4-11(9)12-7-10-3-2-5-14-10/h2-3,5,9,11-12H,4,6-8H2,1H3
InChIKeyFRXVQMTWSZFIJP-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.79
Rot. Bonds3

About N-(furan-2-ylmethyl)-3-methyloxan-4-amine

N-(furan-2-ylmethyl)-3-methyloxan-4-amine (PubChem CID 130173705) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-3-methyloxan-4-amine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-3-methyloxan-4-amine
PubChem CID130173705
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC NameN-(furan-2-ylmethyl)-3-methyloxan-4-amine
SMILESCC1COCCC1NCc1ccco1
InChIInChI=1S/C11H17NO2/c1-9-8-13-6-4-11(9)12-7-10-3-2-5-14-10/h2-3,5,9,11-12H,4,6-8H2,1H3
InChIKeyFRXVQMTWSZFIJP-UHFFFAOYSA-N
XLogP1.79
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(furan-2-ylmethyl)-3-methyloxan-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R,4S)-N-benzyl-3-methyloxan-4-amine
CID 121252774
N-(furan-2-ylmethyl)-2,3-dimethylcyclopentan-1-amine
CID 64908204
N-(furan-2-ylmethyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665299
N-ethyl-3-(furan-2-ylmethylsulfanyl)oxan-4-amine
CID 64609908
3-methyl-N-(1H-pyrazol-5-ylmethyl)oxan-4-amine
CID 130173693
cis-(1S,2R)-2-N-(furan-2-ylmethyl)cyclohexane-1,2-diamine
CID 124676095
cis-(1S,2R)-2-(furan-2-ylmethylamino)cyclohexane-1-carboxylic acid
CID 51556928
cis-(1R,2S)-2-(furan-2-ylmethylamino)cyclohexane-1-carboxylic acid
CID 51440657
(2R,3S)-2-(3,4-difluorophenyl)-N-(furan-2-ylmethyl)oxolan-3-amine
CID 97336723
N-(furan-2-ylmethyl)-2-methylsulfonylcyclopentan-1-amine
CID 65046629
2-cyclohexyl-N-(furan-2-ylmethyl)cyclopropan-1-amine
CID 115655073
3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine
CID 103058819

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-3-methyloxan-4-amine?
The IUPAC name of N-(furan-2-ylmethyl)-3-methyloxan-4-amine (CID 130173705) is N-(furan-2-ylmethyl)-3-methyloxan-4-amine.
What is the SMILES notation for N-(furan-2-ylmethyl)-3-methyloxan-4-amine?
The canonical SMILES for N-(furan-2-ylmethyl)-3-methyloxan-4-amine is CC1COCCC1NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-3-methyloxan-4-amine?
The InChIKey is FRXVQMTWSZFIJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-9-8-13-6-4-11(9)12-7-10-3-2-5-14-10/h2-3,5,9,11-12H,4,6-8H2,1H3.
What are the key properties of N-(furan-2-ylmethyl)-3-methyloxan-4-amine?
N-(furan-2-ylmethyl)-3-methyloxan-4-amine has a molecular weight of 195.26 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-3-methyloxan-4-amine is sourced from PubChem (CID 130173705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).