CID 139243567

C11H15N — CID 139243567

IUPAC—
SMILESCN1[C]C(C)(C)/C=C\C=C/C=C\1
InChIInChI=1S/C11H15N/c1-11(2)8-6-4-5-7-9-12(3)10-11/h4-9H,1-3H3/b5-4-,8-6-,9-7-
InChIKeyOADBUJNYTIAOSU-CBYRLPPOSA-N
MW161.25 g/mol
LogP2.62
Rot. Bonds

About CID 139243567

CID 139243567 (PubChem CID 139243567) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol.

Molecular Properties

Compound NameCID 139243567
PubChem CID139243567
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name—
SMILESCN1[C]C(C)(C)/C=C\C=C/C=C\1
InChIInChI=1S/C11H15N/c1-11(2)8-6-4-5-7-9-12(3)10-11/h4-9H,1-3H3/b5-4-,8-6-,9-7-
InChIKeyOADBUJNYTIAOSU-CBYRLPPOSA-N
XLogP2.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 139243567?
The IUPAC name of CID 139243567 (CID 139243567) is not available.
What is the SMILES notation for CID 139243567?
The canonical SMILES for CID 139243567 is CN1[C]C(C)(C)/C=C\C=C/C=C\1.
What is the InChIKey of CID 139243567?
The InChIKey is OADBUJNYTIAOSU-CBYRLPPOSA-N. The full InChI is InChI=1S/C11H15N/c1-11(2)8-6-4-5-7-9-12(3)10-11/h4-9H,1-3H3/b5-4-,8-6-,9-7-.
What are the key properties of CID 139243567?
CID 139243567 has a molecular weight of 161.25 g/mol, XLogP of 2.62, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 139243567 is sourced from PubChem (CID 139243567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).