CID 101344478

C15H28N3O2 — CID 101344478

IUPAC—
SMILESCC1(C)CC(NC(=O)N2CCCCC2)CC(C)(C)N1[O]
InChIInChI=1S/C15H28N3O2/c1-14(2)10-12(11-15(3,4)18(14)20)16-13(19)17-8-6-5-7-9-17/h12H,5-11H2,1-4H3,(H,16,19)
InChIKeyBTPKWAQLBYRYQN-UHFFFAOYSA-N
MW282.41 g/mol
LogP2.55
Rot. Bonds1

About CID 101344478

CID 101344478 (PubChem CID 101344478) has the molecular formula C15H28N3O2 and a molecular weight of 282.41 g/mol.

Molecular Properties

Compound NameCID 101344478
PubChem CID101344478
Molecular FormulaC15H28N3O2
Molecular Weight282.41 g/mol
Exact Mass282.22
IUPAC Name—
SMILESCC1(C)CC(NC(=O)N2CCCCC2)CC(C)(C)N1[O]
InChIInChI=1S/C15H28N3O2/c1-14(2)10-12(11-15(3,4)18(14)20)16-13(19)17-8-6-5-7-9-17/h12H,5-11H2,1-4H3,(H,16,19)
InChIKeyBTPKWAQLBYRYQN-UHFFFAOYSA-N
XLogP2.55
TPSA55.48 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 101344478?
The IUPAC name of CID 101344478 (CID 101344478) is not available.
What is the SMILES notation for CID 101344478?
The canonical SMILES for CID 101344478 is CC1(C)CC(NC(=O)N2CCCCC2)CC(C)(C)N1[O].
What is the InChIKey of CID 101344478?
The InChIKey is BTPKWAQLBYRYQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N3O2/c1-14(2)10-12(11-15(3,4)18(14)20)16-13(19)17-8-6-5-7-9-17/h12H,5-11H2,1-4H3,(H,16,19).
What are the key properties of CID 101344478?
CID 101344478 has a molecular weight of 282.41 g/mol, XLogP of 2.55, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 101344478 is sourced from PubChem (CID 101344478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).