dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine

C18H23Cl2CrN2- — CID 59793300

IUPACdichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine
SMILESCCCCC(c1cccc(-c2[c-]cccc2)n1)N(C)C.Cl[Cr]Cl
InChIInChI=1S/C18H23N2.2ClH.Cr/c1-4-5-14-18(20(2)3)17-13-9-12-16(19-17)15-10-7-6-8-11-15;;;/h6-10,12-13,18H,4-5,14H2,1-3H3;2*1H;/q-1;;;+2/p-2
InChIKeyQUVQIOKMKSOEKV-UHFFFAOYSA-L
MW390.30 g/mol
LogP5.72
Rot. Bonds6

About dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine

dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine (PubChem CID 59793300) has the molecular formula C18H23Cl2CrN2- and a molecular weight of 390.30 g/mol. Its IUPAC name is dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine.

Molecular Properties

Compound Namedichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine
PubChem CID59793300
Molecular FormulaC18H23Cl2CrN2-
Molecular Weight390.30 g/mol
Exact Mass389.06
IUPAC Namedichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine
SMILESCCCCC(c1cccc(-c2[c-]cccc2)n1)N(C)C.Cl[Cr]Cl
InChIInChI=1S/C18H23N2.2ClH.Cr/c1-4-5-14-18(20(2)3)17-13-9-12-16(19-17)15-10-7-6-8-11-15;;;/h6-10,12-13,18H,4-5,14H2,1-3H3;2*1H;/q-1;;;+2/p-2
InChIKeyQUVQIOKMKSOEKV-UHFFFAOYSA-L
XLogP5.72
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.30
LogP ≤ 55.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine?
The IUPAC name of dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine (CID 59793300) is dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine.
What is the SMILES notation for dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine?
The canonical SMILES for dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine is CCCCC(c1cccc(-c2[c-]cccc2)n1)N(C)C.Cl[Cr]Cl.
What is the InChIKey of dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine?
The InChIKey is QUVQIOKMKSOEKV-UHFFFAOYSA-L. The full InChI is InChI=1S/C18H23N2.2ClH.Cr/c1-4-5-14-18(20(2)3)17-13-9-12-16(19-17)15-10-7-6-8-11-15;;;/h6-10,12-13,18H,4-5,14H2,1-3H3;2*1H;/q-1;;;+2/p-2.
What are the key properties of dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine?
dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine has a molecular weight of 390.30 g/mol, XLogP of 5.72, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichlorochromium;N,N-dimethyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine is sourced from PubChem (CID 59793300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).