CID 71764178

C17H33N3O2 — CID 71764178

IUPAC—
SMILESCC1(C)CC(NC2CC(C)(C)N([O])C2(C)C)CC(C)(C)N1[O]
InChIInChI=1S/C17H33N3O2/c1-14(2)9-12(10-15(3,4)19(14)21)18-13-11-16(5,6)20(22)17(13,7)8/h12-13,18H,9-11H2,1-8H3
InChIKeyCVSGRXVXFULMSB-UHFFFAOYSA-N
MW311.47 g/mol
LogP2.92
Rot. Bonds2

About CID 71764178

CID 71764178 (PubChem CID 71764178) has the molecular formula C17H33N3O2 and a molecular weight of 311.47 g/mol.

Molecular Properties

Compound NameCID 71764178
PubChem CID71764178
Molecular FormulaC17H33N3O2
Molecular Weight311.47 g/mol
Exact Mass311.26
IUPAC Name—
SMILESCC1(C)CC(NC2CC(C)(C)N([O])C2(C)C)CC(C)(C)N1[O]
InChIInChI=1S/C17H33N3O2/c1-14(2)9-12(10-15(3,4)19(14)21)18-13-11-16(5,6)20(22)17(13,7)8/h12-13,18H,9-11H2,1-8H3
InChIKeyCVSGRXVXFULMSB-UHFFFAOYSA-N
XLogP2.92
TPSA58.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.47
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 71764178?
The IUPAC name of CID 71764178 (CID 71764178) is not available.
What is the SMILES notation for CID 71764178?
The canonical SMILES for CID 71764178 is CC1(C)CC(NC2CC(C)(C)N([O])C2(C)C)CC(C)(C)N1[O].
What is the InChIKey of CID 71764178?
The InChIKey is CVSGRXVXFULMSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O2/c1-14(2)9-12(10-15(3,4)19(14)21)18-13-11-16(5,6)20(22)17(13,7)8/h12-13,18H,9-11H2,1-8H3.
What are the key properties of CID 71764178?
CID 71764178 has a molecular weight of 311.47 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 71764178 is sourced from PubChem (CID 71764178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).