N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride

About N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride

N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride (PubChem CID 24850129) has the molecular formula C27H33Cl2N5O8S and a molecular weight of 658.56 g/mol. Its IUPAC name is N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name	N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride
PubChem CID	24850129
Molecular Formula	C27H33Cl2N5O8S
Molecular Weight	658.56 g/mol
Exact Mass	657.14
IUPAC Name	N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride
SMILES	Cl.N[C@@H](CO)C(=O)NCCCCC(=O)N(C[C@H]1CN(c2ccc(N3CCOCC3=O)cc2)C(=O)O1)C(=O)c1ccc(Cl)s1
InChI	InChI=1S/C27H32ClN5O8S.ClH/c28-22-9-8-21(42-22)26(38)33(23(35)3-1-2-10-30-25(37)20(29)15-34)14-19-13-32(27(39)41-19)18-6-4-17(5-7-18)31-11-12-40-16-24(31)36;/h4-9,19-20,34H,1-3,10-16,29H2,(H,30,37);1H/t19-,20+;/m1./s1
InChIKey	FGDBAZPJACTVOO-FDOHDBATSA-N
XLogP	1.79
TPSA	171.81 Å²
H-Bond Donors	3
H-Bond Acceptors	10
Rotatable Bonds	12
Heavy Atoms	43
Complexity	—

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	658.56
LogP ≤ 5	1.79
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

Structural Alerts	{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride?

The IUPAC name of N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride (CID 24850129) is N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride.

What is the SMILES notation for N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride?

The canonical SMILES for N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride is Cl.N[C@@H](CO)C(=O)NCCCCC(=O)N(C[C@H]1CN(c2ccc(N3CCOCC3=O)cc2)C(=O)O1)C(=O)c1ccc(Cl)s1.

What is the InChIKey of N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride?

The InChIKey is FGDBAZPJACTVOO-FDOHDBATSA-N. The full InChI is InChI=1S/C27H32ClN5O8S.ClH/c28-22-9-8-21(42-22)26(38)33(23(35)3-1-2-10-30-25(37)20(29)15-34)14-19-13-32(27(39)41-19)18-6-4-17(5-7-18)31-11-12-40-16-24(31)36;/h4-9,19-20,34H,1-3,10-16,29H2,(H,30,37);1H/t19-,20+;/m1./s1.

What are the key properties of N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride?

N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride has a molecular weight of 658.56 g/mol, XLogP of 1.79, 12 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 24850129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).