CID 177388074

C17H24N2 — CID 177388074

IUPAC
SMILESCC(C)c1cccc(C(C)C)c1N1[C]C(C)(C)N=C1
InChIInChI=1S/C17H24N2/c1-12(2)14-8-7-9-15(13(3)4)16(14)19-10-17(5,6)18-11-19/h7-9,11-13H,1-6H3
InChIKeyVBXRUKBTPGYKDW-UHFFFAOYSA-N
MW256.39 g/mol
LogP4.60
Rot. Bonds3

About CID 177388074

CID 177388074 (PubChem CID 177388074) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol.

Molecular Properties

Compound NameCID 177388074
PubChem CID177388074
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name
SMILESCC(C)c1cccc(C(C)C)c1N1[C]C(C)(C)N=C1
InChIInChI=1S/C17H24N2/c1-12(2)14-8-7-9-15(13(3)4)16(14)19-10-17(5,6)18-11-19/h7-9,11-13H,1-6H3
InChIKeyVBXRUKBTPGYKDW-UHFFFAOYSA-N
XLogP4.60
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze CID 177388074 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 177388074?
The IUPAC name of CID 177388074 (CID 177388074) is not available.
What is the SMILES notation for CID 177388074?
The canonical SMILES for CID 177388074 is CC(C)c1cccc(C(C)C)c1N1[C]C(C)(C)N=C1.
What is the InChIKey of CID 177388074?
The InChIKey is VBXRUKBTPGYKDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-12(2)14-8-7-9-15(13(3)4)16(14)19-10-17(5,6)18-11-19/h7-9,11-13H,1-6H3.
What are the key properties of CID 177388074?
CID 177388074 has a molecular weight of 256.39 g/mol, XLogP of 4.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 177388074 is sourced from PubChem (CID 177388074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).