CID 144774659

C19H33NO2 — CID 144774659

IUPAC—
SMILESCN(C)C.O=C(O)C[C@@H]1CCC2(CC2)C2CCC3(CC3)C2C1
InChIInChI=1S/C16H24O2.C3H9N/c17-14(18)10-11-1-3-15(5-6-15)12-2-4-16(7-8-16)13(12)9-11;1-4(2)3/h11-13H,1-10H2,(H,17,18);1-3H3/t11-,12?,13?;/m1./s1
InChIKeyGHGWOZVNHCHPFR-PATAVHRISA-N
MW307.48 g/mol
LogP4.03
Rot. Bonds2

About CID 144774659

CID 144774659 (PubChem CID 144774659) has the molecular formula C19H33NO2 and a molecular weight of 307.48 g/mol.

Molecular Properties

Compound NameCID 144774659
PubChem CID144774659
Molecular FormulaC19H33NO2
Molecular Weight307.48 g/mol
Exact Mass307.25
IUPAC Name—
SMILESCN(C)C.O=C(O)C[C@@H]1CCC2(CC2)C2CCC3(CC3)C2C1
InChIInChI=1S/C16H24O2.C3H9N/c17-14(18)10-11-1-3-15(5-6-15)12-2-4-16(7-8-16)13(12)9-11;1-4(2)3/h11-13H,1-10H2,(H,17,18);1-3H3/t11-,12?,13?;/m1./s1
InChIKeyGHGWOZVNHCHPFR-PATAVHRISA-N
XLogP4.03
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.48
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 144774623
CID 144774628
CID 144774628
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2-spiro[5.5]undecan-3-ylacetic acid
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Frequently Asked Questions

What is the IUPAC name of CID 144774659?
The IUPAC name of CID 144774659 (CID 144774659) is not available.
What is the SMILES notation for CID 144774659?
The canonical SMILES for CID 144774659 is CN(C)C.O=C(O)C[C@@H]1CCC2(CC2)C2CCC3(CC3)C2C1.
What is the InChIKey of CID 144774659?
The InChIKey is GHGWOZVNHCHPFR-PATAVHRISA-N. The full InChI is InChI=1S/C16H24O2.C3H9N/c17-14(18)10-11-1-3-15(5-6-15)12-2-4-16(7-8-16)13(12)9-11;1-4(2)3/h11-13H,1-10H2,(H,17,18);1-3H3/t11-,12?,13?;/m1./s1.
What are the key properties of CID 144774659?
CID 144774659 has a molecular weight of 307.48 g/mol, XLogP of 4.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 144774659 is sourced from PubChem (CID 144774659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).