butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+)

C34H57NO2U — CID 176663351

IUPACbutane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+)
SMILESCCCC.CCCCC(C)CC.CCCCCN(C=O)C(=O)c1ccccc1C.Cc1[c-]cccc1.[CH3-].[U+2]
InChIInChI=1S/C14H19NO2.C8H18.C7H7.C4H10.CH3.U/c1-3-4-7-10-15(11-16)14(17)13-9-6-5-8-12(13)2;1-4-6-7-8(3)5-2;1-7-5-3-2-4-6-7;1-3-4-2;;/h5-6,8-9,11H,3-4,7,10H2,1-2H3;8H,4-7H2,1-3H3;2-5H,1H3;3-4H2,1-2H3;1H3;/q;;-1;;-1;+2
InChIKeyGITCVWWRBIGIJJ-UHFFFAOYSA-N
MW749.86 g/mol
LogP10.06
Rot. Bonds11

About butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+)

butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+) (PubChem CID 176663351) has the molecular formula C34H57NO2U and a molecular weight of 749.86 g/mol. Its IUPAC name is butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+).

Molecular Properties

Compound Namebutane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+)
PubChem CID176663351
Molecular FormulaC34H57NO2U
Molecular Weight749.86 g/mol
Exact Mass749.49
IUPAC Namebutane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+)
SMILESCCCC.CCCCC(C)CC.CCCCCN(C=O)C(=O)c1ccccc1C.Cc1[c-]cccc1.[CH3-].[U+2]
InChIInChI=1S/C14H19NO2.C8H18.C7H7.C4H10.CH3.U/c1-3-4-7-10-15(11-16)14(17)13-9-6-5-8-12(13)2;1-4-6-7-8(3)5-2;1-7-5-3-2-4-6-7;1-3-4-2;;/h5-6,8-9,11H,3-4,7,10H2,1-2H3;8H,4-7H2,1-3H3;2-5H,1H3;3-4H2,1-2H3;1H3;/q;;-1;;-1;+2
InChIKeyGITCVWWRBIGIJJ-UHFFFAOYSA-N
XLogP10.06
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500749.86
LogP ≤ 510.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Launch Full Analysis

Related Compounds

N-formyl-2-methyl-N-pentylbenzamide
CID 142115251
2-methyl-N,N-dipentylbenzamide
CID 4576290
N-[4-(4-tert-butylphenyl)-4-hydroxybutyl]-N-formyl-2-methylbenzamide
CID 166998810
S-[4-[4-[formyl-(2-methylbenzoyl)amino]butyl]phenyl] N,N-dimethylcarbamothioate
CID 143191201
1,1-di(tetradecyl)urea;1,2-xylene
CID 66809086
N,2-dimethyl-N-pentan-2-ylbenzamide
CID 71253300
diphenylmethanone;3-methylheptane
CID 174880774
2-methylpropyl 2-[di(undecyl)carbamoyl]benzoate
CID 6424181
2-hydroxy-N,N-dioctadecylbenzamide
CID 58731350
3-methyl-1-(2-methylphenyl)pentan-1-one
CID 62620781
butane;3-methyloctane;1,4-xylene
CID 144940276
2-[hexyl(2-hydroxyethyl)carbamoyl]benzoic acid
CID 60949991

Frequently Asked Questions

What is the IUPAC name of butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+)?
The IUPAC name of butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+) (CID 176663351) is butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+).
What is the SMILES notation for butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+)?
The canonical SMILES for butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+) is CCCC.CCCCC(C)CC.CCCCCN(C=O)C(=O)c1ccccc1C.Cc1[c-]cccc1.[CH3-].[U+2].
What is the InChIKey of butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+)?
The InChIKey is GITCVWWRBIGIJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2.C8H18.C7H7.C4H10.CH3.U/c1-3-4-7-10-15(11-16)14(17)13-9-6-5-8-12(13)2;1-4-6-7-8(3)5-2;1-7-5-3-2-4-6-7;1-3-4-2;;/h5-6,8-9,11H,3-4,7,10H2,1-2H3;8H,4-7H2,1-3H3;2-5H,1H3;3-4H2,1-2H3;1H3;/q;;-1;;-1;+2.
What are the key properties of butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+)?
butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+) has a molecular weight of 749.86 g/mol, XLogP of 10.06, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butane;carbanide;N-formyl-2-methyl-N-pentylbenzamide;methylbenzene;3-methylheptane;uranium(2+) is sourced from PubChem (CID 176663351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).