carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane

C18H38MnN4-6 — CID 58836450

IUPACcarbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane
SMILESC[C@@H]1CC(C)(C)[N-]CC[N-][C@H](C)CC(C)(C)[N-]CC[N-]1.[CH3-].[CH3-].[Mn]
InChIInChI=1S/C16H32N4.2CH3.Mn/c1-13-11-15(3,4)19-10-8-18-14(2)12-16(5,6)20-9-7-17-13;;;/h13-14H,7-12H2,1-6H3;2*1H3;/q-4;2*-1;/t13-,14-;;;/m1.../s1
InChIKeyQQYCYDFNHQQRAX-IDHVVMMVSA-N
MW365.47 g/mol
LogP5.51
Rot. Bonds

About carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane

carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane (PubChem CID 58836450) has the molecular formula C18H38MnN4-6 and a molecular weight of 365.47 g/mol. Its IUPAC name is carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane.

Molecular Properties

Compound Namecarbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane
PubChem CID58836450
Molecular FormulaC18H38MnN4-6
Molecular Weight365.47 g/mol
Exact Mass365.25
IUPAC Namecarbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane
SMILESC[C@@H]1CC(C)(C)[N-]CC[N-][C@H](C)CC(C)(C)[N-]CC[N-]1.[CH3-].[CH3-].[Mn]
InChIInChI=1S/C16H32N4.2CH3.Mn/c1-13-11-15(3,4)19-10-8-18-14(2)12-16(5,6)20-9-7-17-13;;;/h13-14H,7-12H2,1-6H3;2*1H3;/q-4;2*-1;/t13-,14-;;;/m1.../s1
InChIKeyQQYCYDFNHQQRAX-IDHVVMMVSA-N
XLogP5.51
TPSA56.40 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.47
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

carbanide;cis-(7S,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane;manganese
CID 58836449
copper-64;trans-(7S,14S)-2,5,5,7,12,12,14-heptamethyl-1,4,8,11-tetrazanidacyclotetradecane
CID 153490885
(2S)-1,1,2-trimethylcyclopropane
CID 25022262
2-methyl-azanidacyclopropane;tantalum
CID 59089984
dicopper bis(2,2,5,5-tetramethyl-3,3a,4,6a-tetrahydropyrrolo[2,3-b]pyrrole-1,6-diide)
CID 140916730
magnesium;2-methylpiperidin-1-ide;chloride
CID 140709501
1,2-dimethyl-1-propan-2-ylcyclopropane
CID 91248342
2,2,4,5-tetramethylthiolane 1,1-dioxide
CID 54264007
(2R)-1-fluoro-1,2-dimethylcyclopropane
CID 147738297
CID 162401464
CID 162401464
azane;1,1,2-trimethylcyclopropane;hydrochloride
CID 174915163
1,1,3-trimethylcyclobutane
CID 12656861

Frequently Asked Questions

What is the IUPAC name of carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane?
The IUPAC name of carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane (CID 58836450) is carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane.
What is the SMILES notation for carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane?
The canonical SMILES for carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane is C[C@@H]1CC(C)(C)[N-]CC[N-][C@H](C)CC(C)(C)[N-]CC[N-]1.[CH3-].[CH3-].[Mn].
What is the InChIKey of carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane?
The InChIKey is QQYCYDFNHQQRAX-IDHVVMMVSA-N. The full InChI is InChI=1S/C16H32N4.2CH3.Mn/c1-13-11-15(3,4)19-10-8-18-14(2)12-16(5,6)20-9-7-17-13;;;/h13-14H,7-12H2,1-6H3;2*1H3;/q-4;2*-1;/t13-,14-;;;/m1.../s1.
What are the key properties of carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane?
carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane has a molecular weight of 365.47 g/mol, XLogP of 5.51, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;manganese;trans-(7R,14R)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazanidacyclotetradecane is sourced from PubChem (CID 58836450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).