N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese

C23H21Cl2MnN5 — CID 21107923

IUPACN,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese
SMILESCl[Mn]Cl.c1ccc(CN(Cc2nc3ccccc3[nH]2)Cc2nc3ccccc3[nH]2)cc1
InChIInChI=1S/C23H21N5.2ClH.Mn/c1-2-8-17(9-3-1)14-28(15-22-24-18-10-4-5-11-19(18)25-22)16-23-26-20-12-6-7-13-21(20)27-23;;;/h1-13H,14-16H2,(H,24,25)(H,26,27);2*1H;/q;;;+2/p-2
InChIKeyUPLPIMCRYIWOPV-UHFFFAOYSA-L
MW493.30 g/mol
LogP6.02
Rot. Bonds6

About N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese

N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese (PubChem CID 21107923) has the molecular formula C23H21Cl2MnN5 and a molecular weight of 493.30 g/mol. Its IUPAC name is N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese.

Molecular Properties

Compound NameN,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese
PubChem CID21107923
Molecular FormulaC23H21Cl2MnN5
Molecular Weight493.30 g/mol
Exact Mass492.06
IUPAC NameN,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese
SMILESCl[Mn]Cl.c1ccc(CN(Cc2nc3ccccc3[nH]2)Cc2nc3ccccc3[nH]2)cc1
InChIInChI=1S/C23H21N5.2ClH.Mn/c1-2-8-17(9-3-1)14-28(15-22-24-18-10-4-5-11-19(18)25-22)16-23-26-20-12-6-7-13-21(20)27-23;;;/h1-13H,14-16H2,(H,24,25)(H,26,27);2*1H;/q;;;+2/p-2
InChIKeyUPLPIMCRYIWOPV-UHFFFAOYSA-L
XLogP6.02
TPSA60.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500493.30
LogP ≤ 56.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;trichlorochromium(1+)
CID 91865506
3-[1H-benzimidazol-2-ylmethyl(benzyl)amino]-2-methylpropan-1-ol
CID 46985414
N-(1H-benzimidazol-2-ylmethyl)-N-[[4-[(Z)-but-2-enyl]-5-methyl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine
CID 142942374
N-(1H-benzimidazol-2-ylmethyl)-N-benzyl-1-(3H-indol-2-yl)methanamine
CID 59163630
N,N-bis(1H-benzimidazol-2-ylmethyl)-2-[3-[2-[bis(1H-benzimidazol-2-ylmethyl)amino]ethyl]phenyl]ethanamine
CID 172879399
trisilver;bis(1-(1H-benzimidazol-2-yl)-N,N-bis(1H-benzimidazol-2-ylmethyl)methanamine);tris(trifluoromethanesulfonate)
CID 139153801
2-N,3-N-bis(1H-benzimidazol-2-ylmethyl)-2-N,3-N-dimethyl-1,4-diphenylbutane-2,3-diamine
CID 175787305
copper;N,N-bis(1H-benzimidazol-2-ylmethyl)-1-thiophen-2-ylmethanamine;dichloride
CID 139158673
2-(10-phenyldecyl)-1H-benzimidazole
CID 53277780
N-(1H-benzimidazol-2-ylmethyl)-N-[(2-methoxyphenyl)methyl]-1-pyridin-3-ylmethanamine
CID 46983929
N-(1H-benzimidazol-2-ylmethyl)-N-ethylbutan-1-amine
CID 82335815
N,N-bis(1H-benzimidazol-2-ylmethyl)-1-(3H-indol-2-yl)methanamine
CID 161048424

Frequently Asked Questions

What is the IUPAC name of N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese?
The IUPAC name of N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese (CID 21107923) is N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese.
What is the SMILES notation for N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese?
The canonical SMILES for N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese is Cl[Mn]Cl.c1ccc(CN(Cc2nc3ccccc3[nH]2)Cc2nc3ccccc3[nH]2)cc1.
What is the InChIKey of N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese?
The InChIKey is UPLPIMCRYIWOPV-UHFFFAOYSA-L. The full InChI is InChI=1S/C23H21N5.2ClH.Mn/c1-2-8-17(9-3-1)14-28(15-22-24-18-10-4-5-11-19(18)25-22)16-23-26-20-12-6-7-13-21(20)27-23;;;/h1-13H,14-16H2,(H,24,25)(H,26,27);2*1H;/q;;;+2/p-2.
What are the key properties of N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese?
N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese has a molecular weight of 493.30 g/mol, XLogP of 6.02, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(1H-benzimidazol-2-ylmethyl)-1-phenylmethanamine;dichloromanganese is sourced from PubChem (CID 21107923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).