N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine

C16H17N3O — CID 106535010

IUPACN'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine
SMILESNCCN(Cc1ccccc1)c1nccc2occc12
InChIInChI=1S/C16H17N3O/c17-8-10-19(12-13-4-2-1-3-5-13)16-14-7-11-20-15(14)6-9-18-16/h1-7,9,11H,8,10,12,17H2
InChIKeyZCNYDTVRCIWNAV-UHFFFAOYSA-N
MW267.33 g/mol
LogP2.79
Rot. Bonds5

About N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine

N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine (PubChem CID 106535010) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine.

Molecular Properties

Compound NameN'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine
PubChem CID106535010
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC NameN'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine
SMILESNCCN(Cc1ccccc1)c1nccc2occc12
InChIInChI=1S/C16H17N3O/c17-8-10-19(12-13-4-2-1-3-5-13)16-14-7-11-20-15(14)6-9-18-16/h1-7,9,11H,8,10,12,17H2
InChIKeyZCNYDTVRCIWNAV-UHFFFAOYSA-N
XLogP2.79
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N'-furo[3,2-c]pyridin-4-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 107494224
N'-benzyl-N'-(3-methyl-2-pyridinyl)ethane-1,2-diamine
CID 62255300
N'-benzyl-N'-(3-bromo-2-pyridinyl)ethane-1,2-diamine
CID 61375800
N'-benzyl-N'-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)ethane-1,2-diamine
CID 61013957
4-[[ethyl(furo[3,2-c]pyridin-4-yl)amino]methyl]-N,N-dimethylbenzamide
CID 86805556
2-[furo[3,2-c]pyridin-4-yl(propyl)amino]acetic acid
CID 106534820
N-[(2-aminophenyl)methyl]-N-propan-2-ylfuro[3,2-c]pyridin-4-amine
CID 106535415
N'-benzyl-N'-(3-fluoro-2-pyridinyl)propane-1,3-diamine
CID 107368121
N'-benzyl-N'-(7H-purin-6-yl)ethane-1,2-diamine
CID 61013592
N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine
CID 107368386
N'-benzyl-N'-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)ethane-1,2-diamine
CID 62831676
2-[2-aminoethyl(benzyl)amino]pyrimidine-4-carbonitrile
CID 107552766

Frequently Asked Questions

What is the IUPAC name of N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine?
The IUPAC name of N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine (CID 106535010) is N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine.
What is the SMILES notation for N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine?
The canonical SMILES for N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine is NCCN(Cc1ccccc1)c1nccc2occc12.
What is the InChIKey of N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine?
The InChIKey is ZCNYDTVRCIWNAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c17-8-10-19(12-13-4-2-1-3-5-13)16-14-7-11-20-15(14)6-9-18-16/h1-7,9,11H,8,10,12,17H2.
What are the key properties of N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine?
N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine has a molecular weight of 267.33 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine is sourced from PubChem (CID 106535010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).