2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide

C14H19N3O2 — CID 64823217

IUPAC2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide
SMILESN#CCCN(Cc1ccco1)C(=O)C1CCCC1N
InChIInChI=1S/C14H19N3O2/c15-7-3-8-17(10-11-4-2-9-19-11)14(18)12-5-1-6-13(12)16/h2,4,9,12-13H,1,3,5-6,8,10,16H2
InChIKeyKIEWCLWLONOVSD-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.65
Rot. Bonds5

About 2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide

2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide (PubChem CID 64823217) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide
PubChem CID64823217
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide
SMILESN#CCCN(Cc1ccco1)C(=O)C1CCCC1N
InChIInChI=1S/C14H19N3O2/c15-7-3-8-17(10-11-4-2-9-19-11)14(18)12-5-1-6-13(12)16/h2,4,9,12-13H,1,3,5-6,8,10,16H2
InChIKeyKIEWCLWLONOVSD-UHFFFAOYSA-N
XLogP1.65
TPSA83.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide (CID 64823217) is 2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide is N#CCCN(Cc1ccco1)C(=O)C1CCCC1N.
What is the InChIKey of 2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide?
The InChIKey is KIEWCLWLONOVSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c15-7-3-8-17(10-11-4-2-9-19-11)14(18)12-5-1-6-13(12)16/h2,4,9,12-13H,1,3,5-6,8,10,16H2.
What are the key properties of 2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide?
2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide has a molecular weight of 261.32 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 64823217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).