3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine

C15H26N2O2 — CID 103058819

IUPAC3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine
SMILESCCCNC1CCOCC1CN(C)Cc1ccco1
InChIInChI=1S/C15H26N2O2/c1-3-7-16-15-6-9-18-12-13(15)10-17(2)11-14-5-4-8-19-14/h4-5,8,13,15-16H,3,6-7,9-12H2,1-2H3
InChIKeyWFMKMPKZQFMJBJ-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.12
Rot. Bonds7

About 3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine

3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine (PubChem CID 103058819) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine.

Molecular Properties

Compound Name3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine
PubChem CID103058819
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine
SMILESCCCNC1CCOCC1CN(C)Cc1ccco1
InChIInChI=1S/C15H26N2O2/c1-3-7-16-15-6-9-18-12-13(15)10-17(2)11-14-5-4-8-19-14/h4-5,8,13,15-16H,3,6-7,9-12H2,1-2H3
InChIKeyWFMKMPKZQFMJBJ-UHFFFAOYSA-N
XLogP2.12
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propylcyclopentan-1-amine
CID 62616260
3-[[methyl(2-phenylethyl)amino]methyl]-N-propyloxan-4-amine
CID 103060387
3-[[cyclopropyl(methyl)amino]methyl]-N-propyloxan-4-amine
CID 103058724
3-[[methyl(pentan-3-yl)amino]methyl]-N-propyloxan-4-amine
CID 103058871
N-ethyl-2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propan-2-ylcyclohexan-1-amine
CID 62708305
3-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]-N-propyloxan-4-amine
CID 103061012
N-ethyl-3-[[methyl-[(3-methylphenyl)methyl]amino]methyl]oxan-4-amine
CID 103059842
3-(2,3-dihydro-1-benzofuran-2-ylmethyl)-N-propyloxan-4-amine
CID 106469582
N-ethyl-3-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]oxan-4-amine
CID 103060638
3-[[(3-bromophenyl)methyl-methylamino]methyl]-N-ethyloxan-4-amine
CID 103059502
3-(furan-3-ylmethyl)-N-propyloxan-4-amine
CID 106469611
N-ethyl-4-[[ethyl(furan-2-ylmethyl)amino]methyl]oxolan-3-amine
CID 66259331

Frequently Asked Questions

What is the IUPAC name of 3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine?
The IUPAC name of 3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine (CID 103058819) is 3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine.
What is the SMILES notation for 3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine?
The canonical SMILES for 3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine is CCCNC1CCOCC1CN(C)Cc1ccco1.
What is the InChIKey of 3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine?
The InChIKey is WFMKMPKZQFMJBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-3-7-16-15-6-9-18-12-13(15)10-17(2)11-14-5-4-8-19-14/h4-5,8,13,15-16H,3,6-7,9-12H2,1-2H3.
What are the key properties of 3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine?
3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine has a molecular weight of 266.38 g/mol, XLogP of 2.12, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propyloxan-4-amine is sourced from PubChem (CID 103058819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).