N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine

C10H18N2O — CID 62682380

IUPACN'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine
SMILESCc1ccc(C(C)N(C)CCN)o1
InChIInChI=1S/C10H18N2O/c1-8-4-5-10(13-8)9(2)12(3)7-6-11/h4-5,9H,6-7,11H2,1-3H3
InChIKeyPODGRJRFODHJOR-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.54
Rot. Bonds4

About N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine

N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine (PubChem CID 62682380) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine
PubChem CID62682380
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC NameN'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine
SMILESCc1ccc(C(C)N(C)CCN)o1
InChIInChI=1S/C10H18N2O/c1-8-4-5-10(13-8)9(2)12(3)7-6-11/h4-5,9H,6-7,11H2,1-3H3
InChIKeyPODGRJRFODHJOR-UHFFFAOYSA-N
XLogP1.54
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 ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine
CID 130615257
1-N-[2-(dimethylamino)ethyl]-1-N-methyl-1-(5-methylfuran-2-yl)propane-1,2-diamine
CID 55225778
2,2-dimethyl-N'-[1-(5-methylfuran-2-yl)ethyl]-N'-propylpropane-1,3-diamine
CID 79668547
1-(5-methylfuran-2-yl)-N,N-bis(2-methylpropyl)ethane-1,2-diamine
CID 61377688
N'-[1-[4-(dimethylamino)phenyl]ethyl]-N'-methylethane-1,2-diamine
CID 62682189
N'-[1-(5-bromofuran-2-yl)ethyl]-N,N'-dimethylethane-1,2-diamine
CID 104653793
2-methyl-1-(5-methylfuran-2-yl)propan-1-amine;hydrochloride
CID 86263157
4-amino-1-(5-methylfuran-2-yl)butan-1-ol
CID 82412823
2-methyl-5-[(2S)-3-methylbutan-2-yl]furan
CID 59302907
2-[2-[[2-amino-1-(5-methylfuran-2-yl)ethyl]-methylamino]ethoxy]ethanol
CID 114243000
N'-methyl-N'-[1-[4-(trifluoromethyl)phenyl]ethyl]ethane-1,2-diamine
CID 62682731
N,N,3,3-tetramethyl-1-(5-methylfuran-2-yl)butane-1,4-diamine
CID 116905767

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine?
The IUPAC name of N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine (CID 62682380) is N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine.
What is the SMILES notation for N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine?
The canonical SMILES for N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine is Cc1ccc(C(C)N(C)CCN)o1.
What is the InChIKey of N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine?
The InChIKey is PODGRJRFODHJOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-8-4-5-10(13-8)9(2)12(3)7-6-11/h4-5,9H,6-7,11H2,1-3H3.
What are the key properties of N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine?
N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine has a molecular weight of 182.27 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-[1-(5-methylfuran-2-yl)ethyl]ethane-1,2-diamine is sourced from PubChem (CID 62682380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).