N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide

C19H25N3O4 — CID 52509086

IUPACN-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide
SMILESC[C@H](NC(=O)c1ccc(N2CCCCC2=O)cc1)C(=O)N1CCOCC1
InChIInChI=1S/C19H25N3O4/c1-14(19(25)21-10-12-26-13-11-21)20-18(24)15-5-7-16(8-6-15)22-9-3-2-4-17(22)23/h5-8,14H,2-4,9-13H2,1H3,(H,20,24)/t14-/m0/s1
InChIKeyHCXUARMSCAGUTE-AWEZNQCLSA-N
MW359.43 g/mol
LogP1.18
Rot. Bonds4

About N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide

N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide (PubChem CID 52509086) has the molecular formula C19H25N3O4 and a molecular weight of 359.43 g/mol. Its IUPAC name is N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide.

Molecular Properties

Compound NameN-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide
PubChem CID52509086
Molecular FormulaC19H25N3O4
Molecular Weight359.43 g/mol
Exact Mass359.18
IUPAC NameN-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide
SMILESC[C@H](NC(=O)c1ccc(N2CCCCC2=O)cc1)C(=O)N1CCOCC1
InChIInChI=1S/C19H25N3O4/c1-14(19(25)21-10-12-26-13-11-21)20-18(24)15-5-7-16(8-6-15)22-9-3-2-4-17(22)23/h5-8,14H,2-4,9-13H2,1H3,(H,20,24)/t14-/m0/s1
InChIKeyHCXUARMSCAGUTE-AWEZNQCLSA-N
XLogP1.18
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide?
The IUPAC name of N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide (CID 52509086) is N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide.
What is the SMILES notation for N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide?
The canonical SMILES for N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide is C[C@H](NC(=O)c1ccc(N2CCCCC2=O)cc1)C(=O)N1CCOCC1.
What is the InChIKey of N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide?
The InChIKey is HCXUARMSCAGUTE-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H25N3O4/c1-14(19(25)21-10-12-26-13-11-21)20-18(24)15-5-7-16(8-6-15)22-9-3-2-4-17(22)23/h5-8,14H,2-4,9-13H2,1H3,(H,20,24)/t14-/m0/s1.
What are the key properties of N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide?
N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide has a molecular weight of 359.43 g/mol, XLogP of 1.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide is sourced from PubChem (CID 52509086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).