N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine

C16H28N2O2 — CID 62391822

IUPACN-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine
SMILESCC(C)NCC1(CN(C)Cc2ccco2)CCOCC1
InChIInChI=1S/C16H28N2O2/c1-14(2)17-12-16(6-9-19-10-7-16)13-18(3)11-15-5-4-8-20-15/h4-5,8,14,17H,6-7,9-13H2,1-3H3
InChIKeyBSDHJMQGWNHAHL-UHFFFAOYSA-N
MW280.41 g/mol
LogP2.51
Rot. Bonds7

About N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine

N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine (PubChem CID 62391822) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine
PubChem CID62391822
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC NameN-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine
SMILESCC(C)NCC1(CN(C)Cc2ccco2)CCOCC1
InChIInChI=1S/C16H28N2O2/c1-14(2)17-12-16(6-9-19-10-7-16)13-18(3)11-15-5-4-8-20-15/h4-5,8,14,17H,6-7,9-13H2,1-3H3
InChIKeyBSDHJMQGWNHAHL-UHFFFAOYSA-N
XLogP2.51
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[4-(aminomethyl)oxan-4-yl]methyl]-1-(furan-2-yl)-N-methylmethanamine
CID 62392008
1-(furan-2-yl)-N-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]methanamine
CID 62258015
N-[[3-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-3-yl]methyl]ethanamine
CID 63739772
N-[[4-[[(4-bromothiophen-2-yl)methyl-methylamino]methyl]oxan-4-yl]methyl]propan-2-amine
CID 62392031
N'-(furan-2-ylmethyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine
CID 60843082
N-methyl-N-[[4-[(propan-2-ylamino)methyl]oxan-4-yl]methyl]butan-1-amine
CID 62392512
N-[[1-[[furan-3-ylmethyl(methyl)amino]methyl]cyclopentyl]methyl]propan-2-amine
CID 62259646
N-[[3-[[methyl(2-thiophen-2-ylethyl)amino]methyl]oxolan-3-yl]methyl]propan-2-amine
CID 79486829
3-methoxy-N-methyl-N-[[4-[(propan-2-ylamino)methyl]oxan-4-yl]methyl]propan-1-amine
CID 63009367
N-[[4-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62391480
N-[[4-(2-methylpropyl)oxan-4-yl]methyl]propan-2-amine
CID 62905553
N-ethyl-2-methyl-N-[[4-[(propan-2-ylamino)methyl]oxan-4-yl]methyl]propan-1-amine
CID 62392347

Frequently Asked Questions

What is the IUPAC name of N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine?
The IUPAC name of N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine (CID 62391822) is N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine is CC(C)NCC1(CN(C)Cc2ccco2)CCOCC1.
What is the InChIKey of N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine?
The InChIKey is BSDHJMQGWNHAHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-14(2)17-12-16(6-9-19-10-7-16)13-18(3)11-15-5-4-8-20-15/h4-5,8,14,17H,6-7,9-13H2,1-3H3.
What are the key properties of N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine?
N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine has a molecular weight of 280.41 g/mol, XLogP of 2.51, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[[furan-2-ylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 62391822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).