CID 173431785

C15H28GeN3O4 — CID 173431785

IUPAC—
SMILESCN1CCN(CCC(=O)N(C)c2ccc([Ge])cc2)CC1.O.O.O
InChIInChI=1S/C15H22GeN3O.3H2O/c1-17-9-11-19(12-10-17)8-7-15(20)18(2)14-5-3-13(16)4-6-14;;;/h3-6H,7-12H2,1-2H3;3*1H2
InChIKeyPNCWYSHZFVJOPE-UHFFFAOYSA-N
MW387.02 g/mol
LogP-2.39
Rot. Bonds4

About CID 173431785

CID 173431785 (PubChem CID 173431785) has the molecular formula C15H28GeN3O4 and a molecular weight of 387.02 g/mol.

Molecular Properties

Compound NameCID 173431785
PubChem CID173431785
Molecular FormulaC15H28GeN3O4
Molecular Weight387.02 g/mol
Exact Mass388.13
IUPAC Name—
SMILESCN1CCN(CCC(=O)N(C)c2ccc([Ge])cc2)CC1.O.O.O
InChIInChI=1S/C15H22GeN3O.3H2O/c1-17-9-11-19(12-10-17)8-7-15(20)18(2)14-5-3-13(16)4-6-14;;;/h3-6H,7-12H2,1-2H3;3*1H2
InChIKeyPNCWYSHZFVJOPE-UHFFFAOYSA-N
XLogP-2.39
TPSA121.29 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.02
LogP ≤ 5-2.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 69059607
N-methyl-3-(4-methylpiperazin-1-yl)-N-phenylpropanamide
CID 110856844
N-methyl-N-(4-methylphenyl)-2-(4-methylpiperazin-1-yl)acetamide
CID 70321883
N-methyl-N-phenyl-3-piperidin-1-ylpropanamide
CID 110688340
CID 173431804
CID 173431804
N-methyl-N-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]hexanamide
CID 70058532
N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide
CID 109014553
3-[4-[2-(N-methylanilino)-2-oxoethyl]piperazin-1-yl]propanoic acid
CID 134069440
CID 88747935
CID 88747935
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-methyl-N-phenylpropanamide
CID 109029653
N-methyl-2-(4-methylpiperazin-1-yl)-N-(4-phenylsulfanylphenyl)acetamide
CID 12734396
CID 88746072
CID 88746072

Frequently Asked Questions

What is the IUPAC name of CID 173431785?
The IUPAC name of CID 173431785 (CID 173431785) is not available.
What is the SMILES notation for CID 173431785?
The canonical SMILES for CID 173431785 is CN1CCN(CCC(=O)N(C)c2ccc([Ge])cc2)CC1.O.O.O.
What is the InChIKey of CID 173431785?
The InChIKey is PNCWYSHZFVJOPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22GeN3O.3H2O/c1-17-9-11-19(12-10-17)8-7-15(20)18(2)14-5-3-13(16)4-6-14;;;/h3-6H,7-12H2,1-2H3;3*1H2.
What are the key properties of CID 173431785?
CID 173431785 has a molecular weight of 387.02 g/mol, XLogP of -2.39, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173431785 is sourced from PubChem (CID 173431785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).