N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine

C11H20N2O — CID 62422966

IUPACN-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine
SMILESCC(C)CN(C)Cc1occc1CN
InChIInChI=1S/C11H20N2O/c1-9(2)7-13(3)8-11-10(6-12)4-5-14-11/h4-5,9H,6-8,12H2,1-3H3
InChIKeyIQFZHMWNJZWCKM-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.83
Rot. Bonds5

About N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine

N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine (PubChem CID 62422966) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine
PubChem CID62422966
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine
SMILESCC(C)CN(C)Cc1occc1CN
InChIInChI=1S/C11H20N2O/c1-9(2)7-13(3)8-11-10(6-12)4-5-14-11/h4-5,9H,6-8,12H2,1-3H3
InChIKeyIQFZHMWNJZWCKM-UHFFFAOYSA-N
XLogP1.83
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[3-(aminomethyl)furan-2-yl]methyl]-N-methylbutan-2-amine
CID 62419080
N-[[3-(aminomethyl)furan-2-yl]methyl]-N-(2-methoxyethyl)-2-methylpropan-1-amine
CID 62431552
[2-(2-methylpropyl)furan-3-yl]methanamine
CID 82416814
N-[[3-(aminomethyl)furan-2-yl]methyl]-N-methylcyclopentanamine
CID 62419086
N-[[3-(aminomethyl)furan-2-yl]methyl]-N,1-dimethylpiperidin-4-amine
CID 62424649
N-[[3-(aminomethyl)furan-2-yl]methyl]-N,3,5-trimethylaniline
CID 62461981
N,2-dimethyl-N-[[3-[(propan-2-ylamino)methyl]furan-2-yl]methyl]butan-1-amine
CID 62420559
N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine
CID 43271829
N-[[3-(aminomethyl)furan-2-yl]methyl]-N-ethylcyclopropanamine
CID 62420146
N-[[4-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine
CID 62422969
N'-[[2-(aminomethyl)furan-3-yl]methyl]-N,N,N'-trimethylethane-1,2-diamine
CID 63725121
N'-[[3-(ethylaminomethyl)furan-2-yl]methyl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 62428599

Frequently Asked Questions

What is the IUPAC name of N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine?
The IUPAC name of N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine (CID 62422966) is N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine.
What is the SMILES notation for N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine?
The canonical SMILES for N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine is CC(C)CN(C)Cc1occc1CN.
What is the InChIKey of N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine?
The InChIKey is IQFZHMWNJZWCKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-9(2)7-13(3)8-11-10(6-12)4-5-14-11/h4-5,9H,6-8,12H2,1-3H3.
What are the key properties of N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine?
N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine has a molecular weight of 196.29 g/mol, XLogP of 1.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine is sourced from PubChem (CID 62422966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).