1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen

C6H11NO — CID 156853775

IUPAC1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen
SMILESCNCc1ccoc1.[H][H]
InChIInChI=1S/C6H9NO.H2/c1-7-4-6-2-3-8-5-6;/h2-3,5,7H,4H2,1H3;1H
InChIKeyFCJWQLNWUQEECR-UHFFFAOYSA-N
MW113.16 g/mol
LogP1.25
Rot. Bonds2

About 1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen

1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen (PubChem CID 156853775) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen.

Molecular Properties

Compound Name1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen
PubChem CID156853775
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen
SMILESCNCc1ccoc1.[H][H]
InChIInChI=1S/C6H9NO.H2/c1-7-4-6-2-3-8-5-6;/h2-3,5,7H,4H2,1H3;1H
InChIKeyFCJWQLNWUQEECR-UHFFFAOYSA-N
XLogP1.25
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(furan-3-yl)-N-(furan-3-ylmethyl)methanamine
CID 115607346
1-[5-[[furan-3-ylmethyl(methyl)amino]methyl]furan-3-yl]-N-methylmethanamine
CID 62462911
1-[3-(furan-3-ylmethoxy)phenyl]-N-methylmethanamine
CID 106486019
N-ethoxy-1-(furan-3-yl)methanamine
CID 82709352
N-(furan-3-ylmethyl)-1-(4-methylphenyl)methanamine
CID 60980930
3-ethyl-N-(furan-3-ylmethyl)pentan-3-amine
CID 65039941
2-fluoro-N-(furan-3-ylmethyl)-N-methyl-4-(methylaminomethyl)aniline
CID 61422400
N-(furan-3-ylmethyl)-3,5-dimethylcyclohexan-1-amine
CID 64722368
2-(furan-3-ylmethylamino)acetic acid
CID 63204531
1-(furan-3-yl)-N-propan-2-yloxymethanamine
CID 131223098
N-(furan-3-ylmethyl)-2-methylpentan-3-amine
CID 63000846
N-(furan-3-ylmethyl)-2,4,4-trimethylpentan-2-amine
CID 62998644

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen?
The IUPAC name of 1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen (CID 156853775) is 1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen.
What is the SMILES notation for 1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen?
The canonical SMILES for 1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen is CNCc1ccoc1.[H][H].
What is the InChIKey of 1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen?
The InChIKey is FCJWQLNWUQEECR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO.H2/c1-7-4-6-2-3-8-5-6;/h2-3,5,7H,4H2,1H3;1H.
What are the key properties of 1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen?
1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen has a molecular weight of 113.16 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-N-methylmethanamine;molecular hydrogen is sourced from PubChem (CID 156853775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).