N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine

C15H23NO3 — CID 62446310

IUPACN-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine
SMILESCc1oc(CNC2CC2)cc1COCC1CCCO1
InChIInChI=1S/C15H23NO3/c1-11-12(9-17-10-14-3-2-6-18-14)7-15(19-11)8-16-13-4-5-13/h7,13-14,16H,2-6,8-10H2,1H3
InChIKeyYGSIHSCSCQSRSJ-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.54
Rot. Bonds7

About N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine

N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine (PubChem CID 62446310) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine
PubChem CID62446310
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC NameN-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine
SMILESCc1oc(CNC2CC2)cc1COCC1CCCO1
InChIInChI=1S/C15H23NO3/c1-11-12(9-17-10-14-3-2-6-18-14)7-15(19-11)8-16-13-4-5-13/h7,13-14,16H,2-6,8-10H2,1H3
InChIKeyYGSIHSCSCQSRSJ-UHFFFAOYSA-N
XLogP2.54
TPSA43.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine
CID 62444720
N-[[4-(methoxymethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine
CID 62445621
[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine
CID 62445276
N-[[4-(3-methoxypropoxymethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine
CID 62442824
N-[[4-(3,3-dimethylbutoxymethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine
CID 66226191
N-[[5-methyl-4-(oxan-4-yloxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 62441084
N-[[2-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62444616
N-[[4-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran-2-yl]methyl]cyclopropanamine
CID 102986704
N-[[5-methyl-4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxymethyl]furan-2-yl]methyl]cyclopropanamine
CID 62443618
N-[[4-(cyclopentylmethoxymethyl)-5-methylfuran-2-yl]methyl]-2-methylpropan-2-amine
CID 66324001
N-[[6-methyl-4-(oxolan-2-ylmethoxy)-3-pyridinyl]methyl]cyclopropanamine
CID 81253535
N-[[4-[(3,4-dichlorophenoxy)methyl]-5-methylfuran-2-yl]methyl]cyclopropanamine
CID 62486306

Frequently Asked Questions

What is the IUPAC name of N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine (CID 62446310) is N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine is Cc1oc(CNC2CC2)cc1COCC1CCCO1.
What is the InChIKey of N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine?
The InChIKey is YGSIHSCSCQSRSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-11-12(9-17-10-14-3-2-6-18-14)7-15(19-11)8-16-13-4-5-13/h7,13-14,16H,2-6,8-10H2,1H3.
What are the key properties of N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine?
N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine has a molecular weight of 265.35 g/mol, XLogP of 2.54, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-methyl-4-(oxolan-2-ylmethoxymethyl)furan-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62446310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).