1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine

C12H20N2O — CID 117246076

IUPAC1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine
SMILESNC(CNC1CCCC1)Cc1ccco1
InChIInChI=1S/C12H20N2O/c13-10(8-12-6-3-7-15-12)9-14-11-4-1-2-5-11/h3,6-7,10-11,14H,1-2,4-5,8-9,13H2
InChIKeyKUXRWNJGLAWONT-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.68
Rot. Bonds5

About 1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine

1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine (PubChem CID 117246076) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine.

Molecular Properties

Compound Name1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine
PubChem CID117246076
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC Name1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine
SMILESNC(CNC1CCCC1)Cc1ccco1
InChIInChI=1S/C12H20N2O/c13-10(8-12-6-3-7-15-12)9-14-11-4-1-2-5-11/h3,6-7,10-11,14H,1-2,4-5,8-9,13H2
InChIKeyKUXRWNJGLAWONT-UHFFFAOYSA-N
XLogP1.68
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N'-cyclobutyl-2-(furan-2-ylmethyl)propane-1,3-diamine
CID 117246184
1-N-cyclohexyl-3-phenylpropane-1,2-diamine
CID 61149481
1-cyclopentyl-3-(furan-2-yl)propan-2-amine
CID 105029465
N-[3-(furan-2-yl)propyl]cycloheptanamine
CID 60984430
1-N-cyclopentyl-2-N-(furan-2-ylmethyl)-2-N-methylpropane-1,2-diamine
CID 62569713
1-cycloheptyl-2-(furan-2-yl)-N-methylethanamine
CID 83175244
N-[2-(furan-2-ylmethylsulfanyl)ethyl]cyclopentanamine
CID 60663449
[1-cyclohexyl-3-(furan-2-yl)-1-methoxypropan-2-yl]hydrazine
CID 105278680
1-(furan-2-yl)-4-(oxolan-2-yl)butan-2-amine
CID 105029349
2-(cyclohexylamino)-N-(furan-2-ylmethyl)acetamide
CID 54816411
1-(cyclopentylamino)-3-(furan-2-yl)propan-2-one
CID 116559078
N-(1-cyclopentylethyl)-1-(furan-2-yl)propan-2-amine
CID 62634085

Frequently Asked Questions

What is the IUPAC name of 1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine?
The IUPAC name of 1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine (CID 117246076) is 1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine.
What is the SMILES notation for 1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine?
The canonical SMILES for 1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine is NC(CNC1CCCC1)Cc1ccco1.
What is the InChIKey of 1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine?
The InChIKey is KUXRWNJGLAWONT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c13-10(8-12-6-3-7-15-12)9-14-11-4-1-2-5-11/h3,6-7,10-11,14H,1-2,4-5,8-9,13H2.
What are the key properties of 1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine?
1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine has a molecular weight of 208.31 g/mol, XLogP of 1.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclopentyl-3-(furan-2-yl)propane-1,2-diamine is sourced from PubChem (CID 117246076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).