1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide

C19H26N4O3 — CID 3244635

IUPAC1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide
SMILESO=C(NCCN1CCOCC1)C1CCN(c2nc3ccccc3o2)CC1
InChIInChI=1S/C19H26N4O3/c24-18(20-7-10-22-11-13-25-14-12-22)15-5-8-23(9-6-15)19-21-16-3-1-2-4-17(16)26-19/h1-4,15H,5-14H2,(H,20,24)
InChIKeyBBDPKDCDSQRFRW-UHFFFAOYSA-N
MW358.44 g/mol
LogP1.49
Rot. Bonds5

About 1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide

1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide (PubChem CID 3244635) has the molecular formula C19H26N4O3 and a molecular weight of 358.44 g/mol. Its IUPAC name is 1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide
PubChem CID3244635
Molecular FormulaC19H26N4O3
Molecular Weight358.44 g/mol
Exact Mass358.20
IUPAC Name1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide
SMILESO=C(NCCN1CCOCC1)C1CCN(c2nc3ccccc3o2)CC1
InChIInChI=1S/C19H26N4O3/c24-18(20-7-10-22-11-13-25-14-12-22)15-5-8-23(9-6-15)19-21-16-3-1-2-4-17(16)26-19/h1-4,15H,5-14H2,(H,20,24)
InChIKeyBBDPKDCDSQRFRW-UHFFFAOYSA-N
XLogP1.49
TPSA70.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide (CID 3244635) is 1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide is O=C(NCCN1CCOCC1)C1CCN(c2nc3ccccc3o2)CC1.
What is the InChIKey of 1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide?
The InChIKey is BBDPKDCDSQRFRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O3/c24-18(20-7-10-22-11-13-25-14-12-22)15-5-8-23(9-6-15)19-21-16-3-1-2-4-17(16)26-19/h1-4,15H,5-14H2,(H,20,24).
What are the key properties of 1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide?
1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide has a molecular weight of 358.44 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-benzoxazol-2-yl)-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide is sourced from PubChem (CID 3244635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).