1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine

C10H18N2O — CID 79053383

IUPAC1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine
SMILESCN(C)C(C)(C)C(N)c1ccco1
InChIInChI=1S/C10H18N2O/c1-10(2,12(3)4)9(11)8-6-5-7-13-8/h5-7,9H,11H2,1-4H3
InChIKeyBGUGUYFJIVUJQK-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.62
Rot. Bonds3

About 1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine

1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine (PubChem CID 79053383) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine.

Molecular Properties

Compound Name1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine
PubChem CID79053383
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine
SMILESCN(C)C(C)(C)C(N)c1ccco1
InChIInChI=1S/C10H18N2O/c1-10(2,12(3)4)9(11)8-6-5-7-13-8/h5-7,9H,11H2,1-4H3
InChIKeyBGUGUYFJIVUJQK-UHFFFAOYSA-N
XLogP1.62
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-3-(furan-2-yl)-2,2-dimethylpropan-1-ol
CID 130059387
(3S)-3-amino-3-(furan-2-yl)-2,2-dimethylpropanoic acid
CID 55292739
(1R)-2,2,2-trifluoro-1-(furan-2-yl)ethanamine;hydrochloride
CID 131879129
1-(3-bromofuran-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine
CID 79053885
2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine
CID 64770505
2-(furan-2-yl)propanethial
CID 54309432
1-(furan-2-yl)-3,3-dimethylbutan-1-amine;hydrochloride
CID 86263034
(3S)-3-amino-2,2-difluoro-3-(furan-2-yl)propan-1-ol
CID 130700545
1-[[2-amino-1-(furan-2-yl)propyl]-methylamino]-2-methylpropan-2-ol
CID 79384583
(1R,2R)-1,2-bis(furan-2-yl)ethane-1,2-diamine;hydrochloride
CID 156789139
1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 16795656
1-(furan-2-yl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine
CID 83175258

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine?
The IUPAC name of 1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine (CID 79053383) is 1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine.
What is the SMILES notation for 1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine?
The canonical SMILES for 1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine is CN(C)C(C)(C)C(N)c1ccco1.
What is the InChIKey of 1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine?
The InChIKey is BGUGUYFJIVUJQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-10(2,12(3)4)9(11)8-6-5-7-13-8/h5-7,9H,11H2,1-4H3.
What are the key properties of 1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine?
1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine has a molecular weight of 182.27 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine is sourced from PubChem (CID 79053383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).