N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine

C13H22N2O — CID 43266988

IUPACN-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine
SMILESCc1ccc(C(CN)N(C)C2CCCC2)o1
InChIInChI=1S/C13H22N2O/c1-10-7-8-13(16-10)12(9-14)15(2)11-5-3-4-6-11/h7-8,11-12H,3-6,9,14H2,1-2H3
InChIKeyOJSFDILZGVUUHY-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.46
Rot. Bonds4

About N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine

N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine (PubChem CID 43266988) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine
PubChem CID43266988
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC NameN-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine
SMILESCc1ccc(C(CN)N(C)C2CCCC2)o1
InChIInChI=1S/C13H22N2O/c1-10-7-8-13(16-10)12(9-14)15(2)11-5-3-4-6-11/h7-8,11-12H,3-6,9,14H2,1-2H3
InChIKeyOJSFDILZGVUUHY-UHFFFAOYSA-N
XLogP2.46
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(5-bromofuran-2-yl)-N-methyl-N-(1-methylpiperidin-4-yl)ethane-1,2-diamine
CID 16783175
1-(4-chlorophenyl)-N-cyclopentyl-N-methylethane-1,2-diamine
CID 43267005
N-cyclopentyl-1-[4-(difluoromethyl)phenyl]-N-methylethane-1,2-diamine
CID 115524228
N-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)phenyl]ethane-1,2-diamine
CID 43266992
N-cycloheptyl-N-methyl-1-(3-methylthiophen-2-yl)ethane-1,2-diamine
CID 43613882
N-cyclohexyl-N-methyl-1-(3-methylphenyl)ethane-1,2-diamine
CID 16783142
N-cyclopropyl-N-methyl-1-(4-methylphenyl)ethane-1,2-diamine
CID 43264750
1-(5-methylfuran-2-yl)-N,N-bis(2-methylpropyl)ethane-1,2-diamine
CID 61377688
1-(2-chlorophenyl)-N-cyclohexyl-N-methylethane-1,2-diamine
CID 43180386
N-cyclopropyl-1-(5-methylfuran-2-yl)-N-(thiophen-3-ylmethyl)ethane-1,2-diamine
CID 61433709
N-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]-N-(oxolan-3-yl)ethane-1,2-diamine
CID 82735293
N-cycloheptyl-1-(2-ethylphenyl)-N-methylethane-1,2-diamine
CID 62413896

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine?
The IUPAC name of N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine (CID 43266988) is N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine?
The canonical SMILES for N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine is Cc1ccc(C(CN)N(C)C2CCCC2)o1.
What is the InChIKey of N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine?
The InChIKey is OJSFDILZGVUUHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-10-7-8-13(16-10)12(9-14)15(2)11-5-3-4-6-11/h7-8,11-12H,3-6,9,14H2,1-2H3.
What are the key properties of N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine?
N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine has a molecular weight of 222.33 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-methyl-1-(5-methylfuran-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 43266988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).