1-azacycloheptadec-17-ene-6-carboxamide

C17H32N2O — CID 175481376

IUPAC1-azacycloheptadec-17-ene-6-carboxamide
SMILESNC(=O)C1CCCCCCCCCC/C=N\CCCC1
InChIInChI=1S/C17H32N2O/c18-17(20)16-12-8-6-4-2-1-3-5-7-10-14-19-15-11-9-13-16/h14,16H,1-13,15H2,(H2,18,20)/b19-14-
InChIKeyDKAZHNJLHGNFCD-RGEXLXHISA-N
MW280.46 g/mol
LogP4.24
Rot. Bonds1

About 1-azacycloheptadec-17-ene-6-carboxamide

1-azacycloheptadec-17-ene-6-carboxamide (PubChem CID 175481376) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 1-azacycloheptadec-17-ene-6-carboxamide.

Molecular Properties

Compound Name1-azacycloheptadec-17-ene-6-carboxamide
PubChem CID175481376
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name1-azacycloheptadec-17-ene-6-carboxamide
SMILESNC(=O)C1CCCCCCCCCC/C=N\CCCC1
InChIInChI=1S/C17H32N2O/c18-17(20)16-12-8-6-4-2-1-3-5-7-10-14-19-15-11-9-13-16/h14,16H,1-13,15H2,(H2,18,20)/b19-14-
InChIKeyDKAZHNJLHGNFCD-RGEXLXHISA-N
XLogP4.24
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-azacycloheptadec-17-ene-6-carboxamide?
The IUPAC name of 1-azacycloheptadec-17-ene-6-carboxamide (CID 175481376) is 1-azacycloheptadec-17-ene-6-carboxamide.
What is the SMILES notation for 1-azacycloheptadec-17-ene-6-carboxamide?
The canonical SMILES for 1-azacycloheptadec-17-ene-6-carboxamide is NC(=O)C1CCCCCCCCCC/C=N\CCCC1.
What is the InChIKey of 1-azacycloheptadec-17-ene-6-carboxamide?
The InChIKey is DKAZHNJLHGNFCD-RGEXLXHISA-N. The full InChI is InChI=1S/C17H32N2O/c18-17(20)16-12-8-6-4-2-1-3-5-7-10-14-19-15-11-9-13-16/h14,16H,1-13,15H2,(H2,18,20)/b19-14-.
What are the key properties of 1-azacycloheptadec-17-ene-6-carboxamide?
1-azacycloheptadec-17-ene-6-carboxamide has a molecular weight of 280.46 g/mol, XLogP of 4.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-azacycloheptadec-17-ene-6-carboxamide is sourced from PubChem (CID 175481376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).