N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide

C14H24N2O3S — CID 60963859

IUPACN,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide
SMILESO=C(C1CSCN1)N(CC1CCCO1)CC1CCCO1
InChIInChI=1S/C14H24N2O3S/c17-14(13-9-20-10-15-13)16(7-11-3-1-5-18-11)8-12-4-2-6-19-12/h11-13,15H,1-10H2
InChIKeyJCMNJAXWUNSPQE-UHFFFAOYSA-N
MW300.42 g/mol
LogP0.84
Rot. Bonds5

About N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide

N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 60963859) has the molecular formula C14H24N2O3S and a molecular weight of 300.42 g/mol. Its IUPAC name is N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide
PubChem CID60963859
Molecular FormulaC14H24N2O3S
Molecular Weight300.42 g/mol
Exact Mass300.15
IUPAC NameN,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide
SMILESO=C(C1CSCN1)N(CC1CCCO1)CC1CCCO1
InChIInChI=1S/C14H24N2O3S/c17-14(13-9-20-10-15-13)16(7-11-3-1-5-18-11)8-12-4-2-6-19-12/h11-13,15H,1-10H2
InChIKeyJCMNJAXWUNSPQE-UHFFFAOYSA-N
XLogP0.84
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.42
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide (CID 60963859) is N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide is O=C(C1CSCN1)N(CC1CCCO1)CC1CCCO1.
What is the InChIKey of N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is JCMNJAXWUNSPQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3S/c17-14(13-9-20-10-15-13)16(7-11-3-1-5-18-11)8-12-4-2-6-19-12/h11-13,15H,1-10H2.
What are the key properties of N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide?
N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 300.42 g/mol, XLogP of 0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(oxolan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 60963859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).