CID 10635845

C17H23N2O — CID 10635845

IUPAC—
SMILESCC1(C)C=C(CN2Cc3ccccc3C2)C(C)(C)N1[O]
InChIInChI=1S/C17H23N2O/c1-16(2)9-15(17(3,4)19(16)20)12-18-10-13-7-5-6-8-14(13)11-18/h5-9H,10-12H2,1-4H3
InChIKeyBBLXVGDGEXXEIW-UHFFFAOYSA-N
MW271.38 g/mol
LogP3.15
Rot. Bonds2

About CID 10635845

CID 10635845 (PubChem CID 10635845) has the molecular formula C17H23N2O and a molecular weight of 271.38 g/mol.

Molecular Properties

Compound NameCID 10635845
PubChem CID10635845
Molecular FormulaC17H23N2O
Molecular Weight271.38 g/mol
Exact Mass271.18
IUPAC Name—
SMILESCC1(C)C=C(CN2Cc3ccccc3C2)C(C)(C)N1[O]
InChIInChI=1S/C17H23N2O/c1-16(2)9-15(17(3,4)19(16)20)12-18-10-13-7-5-6-8-14(13)11-18/h5-9H,10-12H2,1-4H3
InChIKeyBBLXVGDGEXXEIW-UHFFFAOYSA-N
XLogP3.15
TPSA26.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.38
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 10635845?
The IUPAC name of CID 10635845 (CID 10635845) is not available.
What is the SMILES notation for CID 10635845?
The canonical SMILES for CID 10635845 is CC1(C)C=C(CN2Cc3ccccc3C2)C(C)(C)N1[O].
What is the InChIKey of CID 10635845?
The InChIKey is BBLXVGDGEXXEIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N2O/c1-16(2)9-15(17(3,4)19(16)20)12-18-10-13-7-5-6-8-14(13)11-18/h5-9H,10-12H2,1-4H3.
What are the key properties of CID 10635845?
CID 10635845 has a molecular weight of 271.38 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10635845 is sourced from PubChem (CID 10635845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).