1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine

C10H18N2O — CID 16795656

IUPAC1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
SMILESCC(C)N(C)CC(N)c1ccco1
InChIInChI=1S/C10H18N2O/c1-8(2)12(3)7-9(11)10-5-4-6-13-10/h4-6,8-9H,7,11H2,1-3H3
InChIKeyQZTWNBYGTRTCDR-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.62
Rot. Bonds4

About 1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine

1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine (PubChem CID 16795656) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine.

Molecular Properties

Compound Name1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
PubChem CID16795656
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
SMILESCC(C)N(C)CC(N)c1ccco1
InChIInChI=1S/C10H18N2O/c1-8(2)12(3)7-9(11)10-5-4-6-13-10/h4-6,8-9H,7,11H2,1-3H3
InChIKeyQZTWNBYGTRTCDR-UHFFFAOYSA-N
XLogP1.62
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
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

1-(furan-2-yl)-3-methylbutan-1-amine;hydrochloride
CID 86263007
(1S)-1-(furan-2-yl)propan-1-amine;hydrochloride
CID 11615221
3-amino-3-(furan-2-yl)-N,N-dimethylpropanamide
CID 82075111
2-amino-2-(furan-2-yl)ethanol
CID 54048773
1-(furan-2-yl)butan-1-amine;hydrochloride
CID 86262899
1-(furan-2-yl)-3,3-dimethylbutan-1-amine;hydrochloride
CID 86263034
1-[[2-amino-1-(furan-2-yl)propyl]-methylamino]-2-methylpropan-2-ol
CID 79384583
(1S)-1-(furan-2-yl)-3-methylbut-3-en-1-amine
CID 131000468
1-(furan-2-yl)decan-1-amine
CID 62716123
3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol
CID 175069867
(1S)-1-(furan-2-yl)octan-1-amine
CID 98686139
1-N-[1-(furan-2-yl)propyl]-1-N,4-dimethylpentane-1,3-diamine
CID 115317299

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine?
The IUPAC name of 1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine (CID 16795656) is 1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine.
What is the SMILES notation for 1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine?
The canonical SMILES for 1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine is CC(C)N(C)CC(N)c1ccco1.
What is the InChIKey of 1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine?
The InChIKey is QZTWNBYGTRTCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-8(2)12(3)7-9(11)10-5-4-6-13-10/h4-6,8-9H,7,11H2,1-3H3.
What are the key properties of 1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine?
1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine has a molecular weight of 182.27 g/mol, XLogP of 1.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine is sourced from PubChem (CID 16795656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).